Benzodioxoles

Aromatic organic heterocyclic compounds that consist of a benzene containing the methylenedioxy functional group; methylenedioxy functional groups have two oxygen atoms connected to a methylene bridge.

1 – 15 of 86 results

8-Amino-1-naphthol-3,6-disulfonic acid, monosodium salt hydrate, 80%, tech., Thermo Scientific Chemicals

CAS: 5460-09-3 Molecular Formula: C₁₀H₈NNaO₇S₂·H₂O Molecular Weight (g/mol): 359.32 MDL Number: MFCD00150460 InChI Key: QPILZZVXGUNELN-UHFFFAOYSA-M

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CAS	5460-09-3
Molecular Weight (g/mol)	359.32
MDL Number	MFCD00150460
InChI Key	QPILZZVXGUNELN-UHFFFAOYSA-M
Molecular Formula	C₁₀H₈NNaO₇S₂·H₂O

1,3-Benzodioxole, 99%, Thermo Scientific Chemicals

CAS: 274-09-9 Molecular Formula: C7H6O2 Molecular Weight (g/mol): 122.123 MDL Number: MFCD00005818 InChI Key: FTNJQNQLEGKTGD-UHFFFAOYSA-N Synonym: 1,2-methylenedioxybenzene,benzodioxole,benzo d 1,3 dioxole,1,3-dioxaindan,3,4-methylenedioxybenzene,2h-1,3-benzodioxole,1,2-methylenedioxy benzene,1,3-dioxindan,methylenedioxybenzene,o-methylenedioxy benzene PubChem CID: 9229 ChEBI: CHEBI:38732 IUPAC Name: 1,3-benzodioxole SMILES: C1OC2=CC=CC=C2O1

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PubChem CID	9229
CAS	274-09-9
Molecular Weight (g/mol)	122.123
ChEBI	CHEBI:38732
MDL Number	MFCD00005818
SMILES	C1OC2=CC=CC=C2O1
Synonym	1,2-methylenedioxybenzene,benzodioxole,benzo d 1,3 dioxole,1,3-dioxaindan,3,4-methylenedioxybenzene,2h-1,3-benzodioxole,1,2-methylenedioxy benzene,1,3-dioxindan,methylenedioxybenzene,o-methylenedioxy benzene
IUPAC Name	1,3-benzodioxole
InChI Key	FTNJQNQLEGKTGD-UHFFFAOYSA-N
Molecular Formula	C7H6O2

1,2-Methylenedioxy-4-nitrobenzene, 98+%, Thermo Scientific Chemicals

CAS: 2620-44-2 Molecular Formula: C7H5NO4 Molecular Weight (g/mol): 167.12 MDL Number: MFCD00005824 InChI Key: SNWQAKNKGGOVMO-UHFFFAOYSA-N Synonym: 5-nitrobenzo d 1,3 dioxole,1,2-methylenedioxy-4-nitrobenzene,3,4-methylenedioxynitrobenzene,1,3-benzodioxole, 5-nitro,methylenedioxynitrobenzene,5-nitrobenzodioxole,3,4-methylenedioxy-1-nitrobenzene,5-nitro-2h-1,3-benzodioxole,benzene, 1,2-methylenedioxy-4-nitro PubChem CID: 75798 IUPAC Name: 5-nitro-1,3-benzodioxole SMILES: C1OC2=C(O1)C=C(C=C2)[N+](=O)[O-]

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PubChem CID	75798
CAS	2620-44-2
Molecular Weight (g/mol)	167.12
MDL Number	MFCD00005824
SMILES	C1OC2=C(O1)C=C(C=C2)[N+](=O)[O-]
Synonym	5-nitrobenzo d 1,3 dioxole,1,2-methylenedioxy-4-nitrobenzene,3,4-methylenedioxynitrobenzene,1,3-benzodioxole, 5-nitro,methylenedioxynitrobenzene,5-nitrobenzodioxole,3,4-methylenedioxy-1-nitrobenzene,5-nitro-2h-1,3-benzodioxole,benzene, 1,2-methylenedioxy-4-nitro
IUPAC Name	5-nitro-1,3-benzodioxole
InChI Key	SNWQAKNKGGOVMO-UHFFFAOYSA-N
Molecular Formula	C7H5NO4

3,4-Methylenedioxy-beta-nitrostyrene, 98%, Thermo Scientific™

CAS: 1485-00-3 Molecular Formula: C9H7NO4 Molecular Weight (g/mol): 193.158 MDL Number: MFCD00014575 InChI Key: KFLWBZPSJQPRDD-ONEGZZNKSA-N Synonym: 3,4-methylenedioxy-beta-nitrostyrene,mns,syk inhibitor iii,1,3-benzodioxole, 5-nitrovinyl,5-2-nitrovinyl benzo d 1,3 dioxole,1,3-benzodioxole, 5-2-nitroethenyl,5-2-nitrovinyl-1,3-benzodioxole,5-2-nitroethenyl-1,3-benzodioxole,styrene, 3,4-methylenedioxy-beta-nitro,e-5-2-nitrovinyl benzo d 1,3 dioxole PubChem CID: 672296 IUPAC Name: 5-[(E)-2-nitroethenyl]-1,3-benzodioxole SMILES: C1OC2=C(O1)C=C(C=C2)C=C[N+](=O)[O-]

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PubChem CID	672296
CAS	1485-00-3
Molecular Weight (g/mol)	193.158
MDL Number	MFCD00014575
SMILES	C1OC2=C(O1)C=C(C=C2)C=C[N+](=O)[O-]
Synonym	3,4-methylenedioxy-beta-nitrostyrene,mns,syk inhibitor iii,1,3-benzodioxole, 5-nitrovinyl,5-2-nitrovinyl benzo d 1,3 dioxole,1,3-benzodioxole, 5-2-nitroethenyl,5-2-nitrovinyl-1,3-benzodioxole,5-2-nitroethenyl-1,3-benzodioxole,styrene, 3,4-methylenedioxy-beta-nitro,e-5-2-nitrovinyl benzo d 1,3 dioxole
IUPAC Name	5-[(E)-2-nitroethenyl]-1,3-benzodioxole
InChI Key	KFLWBZPSJQPRDD-ONEGZZNKSA-N
Molecular Formula	C9H7NO4

4',5'-Methylenedioxy-2'-nitroacetophenone, 96%, Thermo Scientific Chemicals

CAS: 56136-84-6 Molecular Formula: C9H7NO5 Molecular Weight (g/mol): 209.157 MDL Number: MFCD00053045 InChI Key: BQONDGIXVHVIIR-UHFFFAOYSA-N Synonym: 1-6-nitro-1,3-benzodioxol-5-yl ethanone,4',5'-methylenedioxy-2'-nitroacetophenone,4,5-methylenedioxy-2-nitroacetophenone,1-6-nitrobenzo d 1,3 dioxol-5-yl ethanone,1-6-nitro-1,3-benzodioxol-5-yl ethan-1-one,1-6-nitro-2h-1,3-benzodioxol-5-yl ethan-1-one,1-6-nitro-2h-1,3-benzodioxol-5-yl ethanone,5-acetyl-6-nitro-1,3-benzodioxole,4.5-methylenedioxy-2-nitroacetophenone,5-acetyl-6-nitro-2h-benzo d 1,3-dioxolene PubChem CID: 92022 IUPAC Name: 1-(6-nitro-1,3-benzodioxol-5-yl)ethanone SMILES: CC(=O)C1=CC2=C(C=C1[N+](=O)[O-])OCO2

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PubChem CID	92022
CAS	56136-84-6
Molecular Weight (g/mol)	209.157
MDL Number	MFCD00053045
SMILES	CC(=O)C1=CC2=C(C=C1[N+](=O)[O-])OCO2
Synonym	1-6-nitro-1,3-benzodioxol-5-yl ethanone,4',5'-methylenedioxy-2'-nitroacetophenone,4,5-methylenedioxy-2-nitroacetophenone,1-6-nitrobenzo d 1,3 dioxol-5-yl ethanone,1-6-nitro-1,3-benzodioxol-5-yl ethan-1-one,1-6-nitro-2h-1,3-benzodioxol-5-yl ethan-1-one,1-6-nitro-2h-1,3-benzodioxol-5-yl ethanone,5-acetyl-6-nitro-1,3-benzodioxole,4.5-methylenedioxy-2-nitroacetophenone,5-acetyl-6-nitro-2h-benzo d 1,3-dioxolene
IUPAC Name	1-(6-nitro-1,3-benzodioxol-5-yl)ethanone
InChI Key	BQONDGIXVHVIIR-UHFFFAOYSA-N
Molecular Formula	C9H7NO5

4-Hydroxy-3-methoxybenzonitrile, 98%, Thermo Scientific Chemicals

CAS: 4421-08-3 MDL Number: MFCD00001820

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CAS	4421-08-3
MDL Number	MFCD00001820

3,4-(Methylenedioxy)aniline, 98+%, Thermo Scientific Chemicals

CAS: 14268-66-7 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.138 MDL Number: MFCD00005832 InChI Key: XGNXYCFREOZBOL-UHFFFAOYSA-N Synonym: 3,4-methylenedioxy aniline,benzo d 1,3 dioxol-5-amine,5-amino-1,3-benzodioxole,3,4-methylenedioxyaniline,4-amino-1,2-methylenedioxybenzene,5-aminobenzodioxole,methylenedioxyaniline,2h-1,3-benzodioxol-5-amine,1-amino-3,4-methylenedioxybenzene,1-amino-3,4-dimethylenedioxybenzene PubChem CID: 84310 IUPAC Name: 1,3-benzodioxol-5-amine SMILES: C1OC2=C(O1)C=C(C=C2)N

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PubChem CID	84310
CAS	14268-66-7
Molecular Weight (g/mol)	137.138
MDL Number	MFCD00005832
SMILES	C1OC2=C(O1)C=C(C=C2)N
Synonym	3,4-methylenedioxy aniline,benzo d 1,3 dioxol-5-amine,5-amino-1,3-benzodioxole,3,4-methylenedioxyaniline,4-amino-1,2-methylenedioxybenzene,5-aminobenzodioxole,methylenedioxyaniline,2h-1,3-benzodioxol-5-amine,1-amino-3,4-methylenedioxybenzene,1-amino-3,4-dimethylenedioxybenzene
IUPAC Name	1,3-benzodioxol-5-amine
InChI Key	XGNXYCFREOZBOL-UHFFFAOYSA-N
Molecular Formula	C7H7NO2

2,2-Difluoro-1,3-benzodioxole-5-carboxaldehyde, 97%, Thermo Scientific Chemicals

CAS: 656-42-8 Molecular Formula: C8H4F2O3 Molecular Weight (g/mol): 186.114 MDL Number: MFCD00792420 InChI Key: GGERGLKEDUUSAP-UHFFFAOYSA-N Synonym: 2,2-difluorobenzo d 1,3 dioxole-5-carbaldehyde,2,2-difluorobenzodioxole-5-carboxaldehyde,2,2-difluoro-1,3-benzodioxole-5-carboxaldehyde,2,2-difluoro-2h-1,3-benzodioxole-5-carbaldehyde,2,2-difluoro-5-formylbenzodioxole,2,2-difluoro-5-formyl-1,3-benzodioxole,2,2-difluoro-benzo 1,3 dioxole-5-carbaldehyde,5-formyl-2,2-difluorobenzodioxole,1,3-benzodioxole-5-carboxaldehyde, 2,2-difluoro,2,2-difluoro-1,3-benzodioxole-5-arboxaldehyde PubChem CID: 2736973 IUPAC Name: 2,2-difluoro-1,3-benzodioxole-5-carbaldehyde SMILES: C1=CC2=C(C=C1C=O)OC(O2)(F)F

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Specifications

PubChem CID	2736973
CAS	656-42-8
Molecular Weight (g/mol)	186.114
MDL Number	MFCD00792420
SMILES	C1=CC2=C(C=C1C=O)OC(O2)(F)F
Synonym	2,2-difluorobenzo d 1,3 dioxole-5-carbaldehyde,2,2-difluorobenzodioxole-5-carboxaldehyde,2,2-difluoro-1,3-benzodioxole-5-carboxaldehyde,2,2-difluoro-2h-1,3-benzodioxole-5-carbaldehyde,2,2-difluoro-5-formylbenzodioxole,2,2-difluoro-5-formyl-1,3-benzodioxole,2,2-difluoro-benzo 1,3 dioxole-5-carbaldehyde,5-formyl-2,2-difluorobenzodioxole,1,3-benzodioxole-5-carboxaldehyde, 2,2-difluoro,2,2-difluoro-1,3-benzodioxole-5-arboxaldehyde
IUPAC Name	2,2-difluoro-1,3-benzodioxole-5-carbaldehyde
InChI Key	GGERGLKEDUUSAP-UHFFFAOYSA-N
Molecular Formula	C8H4F2O3

5-Bromo-2,2-difluoro-1,3-benzodioxole, 97%, Thermo Scientific Chemicals

CAS: 33070-32-5 Molecular Formula: C7H3BrF2O2 Molecular Weight (g/mol): 237 MDL Number: MFCD00236212 InChI Key: SZRHWHHXVXSGMT-UHFFFAOYSA-N Synonym: 5-bromo-2,2-difluorobenzodioxole,5-bromo-2,2-difluoro-2h-1,3-benzodioxole,5-bromo-2,2-difluorobenzo d 1,3 dioxole,5-bromo-2,2-difluoro-benzo 1,3 dioxole,1,3-benzodioxole, 5-bromo-2,2-difluoro,4-bromo-1,2-difluoromethylenedioxy benzene,5-bromo-2,2-difluorobenzo d 1,3-dioxolene,acmc-209hy8,5-bromo2,2-difluoro-1,3-benzodioxole,2,2-difluoro-5-bromo-1,3-benzodioxole PubChem CID: 2736271 IUPAC Name: 5-bromo-2,2-difluoro-1,3-benzodioxole SMILES: C1=CC2=C(C=C1Br)OC(O2)(F)F

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PubChem CID	2736271
CAS	33070-32-5
Molecular Weight (g/mol)	237
MDL Number	MFCD00236212
SMILES	C1=CC2=C(C=C1Br)OC(O2)(F)F
Synonym	5-bromo-2,2-difluorobenzodioxole,5-bromo-2,2-difluoro-2h-1,3-benzodioxole,5-bromo-2,2-difluorobenzo d 1,3 dioxole,5-bromo-2,2-difluoro-benzo 1,3 dioxole,1,3-benzodioxole, 5-bromo-2,2-difluoro,4-bromo-1,2-difluoromethylenedioxy benzene,5-bromo-2,2-difluorobenzo d 1,3-dioxolene,acmc-209hy8,5-bromo2,2-difluoro-1,3-benzodioxole,2,2-difluoro-5-bromo-1,3-benzodioxole
IUPAC Name	5-bromo-2,2-difluoro-1,3-benzodioxole
InChI Key	SZRHWHHXVXSGMT-UHFFFAOYSA-N
Molecular Formula	C7H3BrF2O2

Piperonyl butoxide, 90%, Tech., Thermo Scientific Chemicals

CAS: 51-03-6 Molecular Formula: C19H30O5 Molecular Weight (g/mol): 338.44 MDL Number: MFCD00005842 InChI Key: FIPWRIJSWJWJAI-UHFFFAOYSA-N Synonym: piperonyl butoxide,butacide,butocide,ethanol butoxide,pyrenone 606,piperonylbutoxide,6-propylpiperonyl butyl diethylene glycol ether,butyl carbitol 6-propylpiperonyl ether,5-2-2-butoxyethoxy ethoxy methyl-6-propylbenzo d 1,3 dioxole,butoxide synergist PubChem CID: 5794 ChEBI: CHEBI:32687 IUPAC Name: 5-[2-(2-butoxyethoxy)ethoxymethyl]-6-propyl-1,3-benzodioxole SMILES: CCCCOCCOCCOCC1=CC2=C(OCO2)C=C1CCC

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PubChem CID	5794
CAS	51-03-6
Molecular Weight (g/mol)	338.44
ChEBI	CHEBI:32687
MDL Number	MFCD00005842
SMILES	CCCCOCCOCCOCC1=CC2=C(OCO2)C=C1CCC
Synonym	piperonyl butoxide,butacide,butocide,ethanol butoxide,pyrenone 606,piperonylbutoxide,6-propylpiperonyl butyl diethylene glycol ether,butyl carbitol 6-propylpiperonyl ether,5-2-2-butoxyethoxy ethoxy methyl-6-propylbenzo d 1,3 dioxole,butoxide synergist
IUPAC Name	5-[2-(2-butoxyethoxy)ethoxymethyl]-6-propyl-1,3-benzodioxole
InChI Key	FIPWRIJSWJWJAI-UHFFFAOYSA-N
Molecular Formula	C19H30O5

n-(1,3-benzodioxol-5-ylmethyl)-n-methylamine, 97%, Thermo Scientific™

CAS: 15205-27-3 Molecular Formula: C9H12NO2 Molecular Weight (g/mol): 166.20 MDL Number: MFCD04496422 InChI Key: CEPGPPSMCRKGFJ-UHFFFAOYSA-O Synonym: n-1,3-benzodioxol-5-ylmethyl-n-methylamine,1-1,3-benzodioxol-5-yl-n-methylmethanamine,2h-1,3-benzodioxol-5-ylmethyl methyl amine,n-methyl-3,4-methylenedioxy benzylamine,1,3-benzodioxole-5-methanamine,n-methyl,1,3-benzodioxole-5-methanamine, n-methyl,2h-1,3-benzodioxol-5-yl methyl methyl amine,1,3-benzodioxol-5-ylmethyl methylaminehydrochloride,n-methylpiperonylamine,3,4-methylenedioxy-n-methylbenzylamine PubChem CID: 421238 SMILES: C[NH2+]CC1=CC=C2OCOC2=C1

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Specifications

PubChem CID	421238
CAS	15205-27-3
Molecular Weight (g/mol)	166.20
MDL Number	MFCD04496422
SMILES	C[NH2+]CC1=CC=C2OCOC2=C1
Synonym	n-1,3-benzodioxol-5-ylmethyl-n-methylamine,1-1,3-benzodioxol-5-yl-n-methylmethanamine,2h-1,3-benzodioxol-5-ylmethyl methyl amine,n-methyl-3,4-methylenedioxy benzylamine,1,3-benzodioxole-5-methanamine,n-methyl,1,3-benzodioxole-5-methanamine, n-methyl,2h-1,3-benzodioxol-5-yl methyl methyl amine,1,3-benzodioxol-5-ylmethyl methylaminehydrochloride,n-methylpiperonylamine,3,4-methylenedioxy-n-methylbenzylamine
InChI Key	CEPGPPSMCRKGFJ-UHFFFAOYSA-O
Molecular Formula	C9H12NO2

Piperonyloyl chloride, 98%, Thermo Scientific Chemicals

CAS: 25054-53-9 Molecular Formula: C₈H₅ClO₃ Molecular Weight (g/mol): 184.58 MDL Number: MFCD00016904 InChI Key: ZRSGZIMDIHBXIN-UHFFFAOYSA-N Synonym: piperonyloyl chloride,benzo d 1,3 dioxole-5-carbonyl chloride,2h-1,3-benzodioxole-5-carbonyl chloride,piperonoyl chloride,benzo 1,3 dioxole-5-carbonyl chloride,acmc-20ajvo,piperonylic acid chloride,3,4-methylenedioxybenzoylchloride,3,4-methylenedioxybenzoyl chloride PubChem CID: 2734749 IUPAC Name: 1,3-benzodioxole-5-carbonyl chloride SMILES: C1OC2=C(O1)C=C(C=C2)C(=O)Cl

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Specifications

PubChem CID	2734749
CAS	25054-53-9
Molecular Weight (g/mol)	184.58
MDL Number	MFCD00016904
SMILES	C1OC2=C(O1)C=C(C=C2)C(=O)Cl
Synonym	piperonyloyl chloride,benzo d 1,3 dioxole-5-carbonyl chloride,2h-1,3-benzodioxole-5-carbonyl chloride,piperonoyl chloride,benzo 1,3 dioxole-5-carbonyl chloride,acmc-20ajvo,piperonylic acid chloride,3,4-methylenedioxybenzoylchloride,3,4-methylenedioxybenzoyl chloride
IUPAC Name	1,3-benzodioxole-5-carbonyl chloride
InChI Key	ZRSGZIMDIHBXIN-UHFFFAOYSA-N
Molecular Formula	C₈H₅ClO₃

1,3-Benzodioxol-5-ylmethyl isothiocyanate, ≥95%, Thermo Scientific™

CAS: 4430-47-1 Molecular Formula: C9H7NO2S Molecular Weight (g/mol): 193.22 MDL Number: MFCD00041217 InChI Key: PUJWRDBPAFJUJW-UHFFFAOYSA-N Synonym: 3,4-methylenedioxy benzyl isothiocyanate,1,3-benzodioxol-5-ylmethyl isothiocyanate,5-isothiocyanatomethyl-1,3-benzodioxole,3,4-methylenedioxybenzyl isothiocyanate,5-isothiocyanatomethyl-2h-1,3-benzodioxole,5-isothiocyanatomethyl-benzo 1,3 dioxole,5-isothiocyanatomethyl benzo d 1,3 dioxole,acmc-20angn,pubchem9883,akos bbr-002798 PubChem CID: 2795371 IUPAC Name: 5-(isothiocyanatomethyl)-1,3-benzodioxole SMILES: S=C=NCC1=CC=C2OCOC2=C1

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Specifications

PubChem CID	2795371
CAS	4430-47-1
Molecular Weight (g/mol)	193.22
MDL Number	MFCD00041217
SMILES	S=C=NCC1=CC=C2OCOC2=C1
Synonym	3,4-methylenedioxy benzyl isothiocyanate,1,3-benzodioxol-5-ylmethyl isothiocyanate,5-isothiocyanatomethyl-1,3-benzodioxole,3,4-methylenedioxybenzyl isothiocyanate,5-isothiocyanatomethyl-2h-1,3-benzodioxole,5-isothiocyanatomethyl-benzo 1,3 dioxole,5-isothiocyanatomethyl benzo d 1,3 dioxole,acmc-20angn,pubchem9883,akos bbr-002798
IUPAC Name	5-(isothiocyanatomethyl)-1,3-benzodioxole
InChI Key	PUJWRDBPAFJUJW-UHFFFAOYSA-N
Molecular Formula	C9H7NO2S

3,4-(Methylenedioxy)phenylmagnesium bromide, 0.50 M in 2-MeTHF, Thermo Scientific Chemicals

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4-Bromo-2,2-difluoro-1,3-benzodioxole, 97%, Thermo Scientific Chemicals

CAS: 144584-66-7 Molecular Formula: C7H3BrF2O2 Molecular Weight (g/mol): 237 MDL Number: MFCD01631385 InChI Key: LSZYHXNOLVSZHH-UHFFFAOYSA-N Synonym: 4-bromo-2,2-difluorobenzo d 1,3 dioxole,4-bromo-2,2-difluoro-2h-1,3-benzodioxole,2,2-difluoro-4-bromo-1,3-benzodioxole,1,3-benzodioxol-4-bromo, 2,2-difluoro,4-bromo-2,2-difluoro-benzo 1,3 dioxole,4-bromo-2,2-difluorobenzo d 1,3-dioxolene,acmc-20a3ue,4-bromo-2,2-difluoro-1,3-benzodioxol,1,3-benzodioxole,4-bromo-2,2-difluoro,4-bromo-2,2-difluoro-1,3-benzodioxolane PubChem CID: 2773297 IUPAC Name: 4-bromo-2,2-difluoro-1,3-benzodioxole SMILES: C1=CC2=C(C(=C1)Br)OC(O2)(F)F

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Specifications

PubChem CID	2773297
CAS	144584-66-7
Molecular Weight (g/mol)	237
MDL Number	MFCD01631385
SMILES	C1=CC2=C(C(=C1)Br)OC(O2)(F)F
Synonym	4-bromo-2,2-difluorobenzo d 1,3 dioxole,4-bromo-2,2-difluoro-2h-1,3-benzodioxole,2,2-difluoro-4-bromo-1,3-benzodioxole,1,3-benzodioxol-4-bromo, 2,2-difluoro,4-bromo-2,2-difluoro-benzo 1,3 dioxole,4-bromo-2,2-difluorobenzo d 1,3-dioxolene,acmc-20a3ue,4-bromo-2,2-difluoro-1,3-benzodioxol,1,3-benzodioxole,4-bromo-2,2-difluoro,4-bromo-2,2-difluoro-1,3-benzodioxolane
IUPAC Name	4-bromo-2,2-difluoro-1,3-benzodioxole
InChI Key	LSZYHXNOLVSZHH-UHFFFAOYSA-N
Molecular Formula	C7H3BrF2O2

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