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Benzisoxazoles

Benzisoxazoles

Aromatic organic heterocyclic compounds that consist of benzene fused with an isoxazole; isoxazoles are an azole with an oxygen atom next to the nitrogen atom.
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1 – 11 of 11 results
1

1,2-Benzisoxazole, 95%, Thermo Scientific Chemicals

CAS: 271-95-4 Molecular Formula: C7H5NO Molecular Weight (g/mol): 119.123 MDL Number: MFCD00005852 InChI Key: KTZQTRPPVKQPFO-UHFFFAOYSA-N Synonym: 1,2-benzisoxazole,benzo d isoxazole,indoxazene,benzisoxazole,benz d isoxazole,4,5-benzisoxazole,1-oxa-2-aza-1h-indene,benzoisoxazole,indoxazine,isoindoxazine PubChem CID: 71073 ChEBI: CHEBI:51554 IUPAC Name: 1,2-benzoxazole SMILES: C1=CC=C2C(=C1)C=NO2

PubChem CID 71073
CAS 271-95-4
Molecular Weight (g/mol) 119.123
ChEBI CHEBI:51554
MDL Number MFCD00005852
SMILES C1=CC=C2C(=C1)C=NO2
Synonym 1,2-benzisoxazole,benzo d isoxazole,indoxazene,benzisoxazole,benz d isoxazole,4,5-benzisoxazole,1-oxa-2-aza-1h-indene,benzoisoxazole,indoxazine,isoindoxazine
IUPAC Name 1,2-benzoxazole
InChI Key KTZQTRPPVKQPFO-UHFFFAOYSA-N
Molecular Formula C7H5NO
3

5-bromo-1,2-benzisoxazol-3-ylamine, 97%, Thermo Scientific™

CAS: 455280-00-9 Molecular Formula: C7H5BrN2O Molecular Weight (g/mol): 213.03 MDL Number: MFCD09834823 InChI Key: BGMYWBQEKIMHGU-UHFFFAOYSA-N Synonym: 5-bromobenzo d isoxazol-3-ylamine,5-bromobenzo d isoxazol-3-amine,5-bromo-1,2-benzisoxazol-3-ylamine,1,2-benzisoxazol-3-amine, 5-bromo,3-amino-5-bromobenzo d isoxazole,5-bromobenzo d isoxazole-3-ylamine,5-bromanyl-1,2-benzoxazol-3-amine,1,2-benzisoxazol-3-amine,5-bromo PubChem CID: 33589610 IUPAC Name: 5-bromo-1,2-benzoxazol-3-amine SMILES: NC1=NOC2=CC=C(Br)C=C12

PubChem CID 33589610
CAS 455280-00-9
Molecular Weight (g/mol) 213.03
MDL Number MFCD09834823
SMILES NC1=NOC2=CC=C(Br)C=C12
Synonym 5-bromobenzo d isoxazol-3-ylamine,5-bromobenzo d isoxazol-3-amine,5-bromo-1,2-benzisoxazol-3-ylamine,1,2-benzisoxazol-3-amine, 5-bromo,3-amino-5-bromobenzo d isoxazole,5-bromobenzo d isoxazole-3-ylamine,5-bromanyl-1,2-benzoxazol-3-amine,1,2-benzisoxazol-3-amine,5-bromo
IUPAC Name 5-bromo-1,2-benzoxazol-3-amine
InChI Key BGMYWBQEKIMHGU-UHFFFAOYSA-N
Molecular Formula C7H5BrN2O
4

2-(1,2-Benzisoxazol-3-yl)acetic acid, 97%, Thermo Scientific™

CAS: 4865-84-3 Molecular Formula: C9H6NO3 Molecular Weight (g/mol): 176.15 MDL Number: MFCD02180388 InChI Key: BVSIAYQIMUUCRW-UHFFFAOYSA-M Synonym: 2-1,2-benzisoxazol-3-yl acetic acid,1,2-benzisoxazole-3-acetic acid,1,2-benzisoxazol-3-ylacetic acid,2-1,2-benzoxazol-3-yl acetic acid,2-benzo d isoxazol-3-yl acetic acid,1,2-benzoxazol-3-ylacetic acid,2-benzo d isoxazol-3-ylacetic acid,2-1,2-benzoxazol-3-yl ethanoic acid,nvu,zlchem 388 PubChem CID: 301729 SMILES: [O-]C(=O)CC1=NOC2=CC=CC=C12

PubChem CID 301729
CAS 4865-84-3
Molecular Weight (g/mol) 176.15
MDL Number MFCD02180388
SMILES [O-]C(=O)CC1=NOC2=CC=CC=C12
Synonym 2-1,2-benzisoxazol-3-yl acetic acid,1,2-benzisoxazole-3-acetic acid,1,2-benzisoxazol-3-ylacetic acid,2-1,2-benzoxazol-3-yl acetic acid,2-benzo d isoxazol-3-yl acetic acid,1,2-benzoxazol-3-ylacetic acid,2-benzo d isoxazol-3-ylacetic acid,2-1,2-benzoxazol-3-yl ethanoic acid,nvu,zlchem 388
InChI Key BVSIAYQIMUUCRW-UHFFFAOYSA-M
Molecular Formula C9H6NO3
5

3-chloro-1,2-benzisoxazole, 97%, Thermo Scientific™

CAS: 16263-52-8 Molecular Formula: C7H4ClNO Molecular Weight (g/mol): 153.565 MDL Number: MFCD03407314 InChI Key: INWUFXPCLZRSBH-UHFFFAOYSA-N PubChem CID: 2779780 IUPAC Name: 3-chloro-1,2-benzoxazole SMILES: C1=CC=C2C(=C1)C(=NO2)Cl

PubChem CID 2779780
CAS 16263-52-8
Molecular Weight (g/mol) 153.565
MDL Number MFCD03407314
SMILES C1=CC=C2C(=C1)C(=NO2)Cl
IUPAC Name 3-chloro-1,2-benzoxazole
InChI Key INWUFXPCLZRSBH-UHFFFAOYSA-N
Molecular Formula C7H4ClNO
6

5-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazole hydrochloride, 96%, Thermo Scientific Chemicals

CAS: 84163-16-6 Molecular Formula: C12H14ClFN2O Molecular Weight (g/mol): 256.705 MDL Number: MFCD06200879 InChI Key: HSOJFILHZZEWJT-UHFFFAOYSA-N Synonym: 5-fluoro-3-piperidin-4-yl benzo d isoxazole hydrochloride,5-fluoro-3-piperidin-4-yl-1,2-benzisoxazole hydrochloride,5-fluoro-3-4-piperidinyl-1,2-benzisoxazole hydrochloride,5-fluoro-3-piperidin-4-yl-1,2-benzoxazole hydrochloride,5-fluoro-3-piperidin-4-yl benzo d isoxazole hcl,4-5-fluoro-1,2-benzisoxazol-3-yl piperidine hydrochloride,1,2-benzisoxazole,5-fluoro-3-4-piperidinyl-, hydrochloride,pubchem11469,5-fluoro-3-piperidin-4-yl benzisoxazole hcl salt,5-fluoro-3-4-piperidyl benzo d isoxazole, chloride PubChem CID: 2794754 IUPAC Name: 5-fluoro-3-piperidin-4-yl-1,2-benzoxazole;hydrochloride SMILES: C1CNCCC1C2=NOC3=C2C=C(C=C3)F.Cl

PubChem CID 2794754
CAS 84163-16-6
Molecular Weight (g/mol) 256.705
MDL Number MFCD06200879
SMILES C1CNCCC1C2=NOC3=C2C=C(C=C3)F.Cl
Synonym 5-fluoro-3-piperidin-4-yl benzo d isoxazole hydrochloride,5-fluoro-3-piperidin-4-yl-1,2-benzisoxazole hydrochloride,5-fluoro-3-4-piperidinyl-1,2-benzisoxazole hydrochloride,5-fluoro-3-piperidin-4-yl-1,2-benzoxazole hydrochloride,5-fluoro-3-piperidin-4-yl benzo d isoxazole hcl,4-5-fluoro-1,2-benzisoxazol-3-yl piperidine hydrochloride,1,2-benzisoxazole,5-fluoro-3-4-piperidinyl-, hydrochloride,pubchem11469,5-fluoro-3-piperidin-4-yl benzisoxazole hcl salt,5-fluoro-3-4-piperidyl benzo d isoxazole, chloride
IUPAC Name 5-fluoro-3-piperidin-4-yl-1,2-benzoxazole;hydrochloride
InChI Key HSOJFILHZZEWJT-UHFFFAOYSA-N
Molecular Formula C12H14ClFN2O
7

Zonisamide, Thermo Scientific Chemicals

CAS: 68291-97-4 Molecular Formula: C8H8N2O3S Molecular Weight (g/mol): 212.22 MDL Number: MFCD00865316 InChI Key: UBQNRHZMVUUOMG-UHFFFAOYSA-N IUPAC Name: (1,2-benzoxazol-3-yl)methanesulfonamide SMILES: NS(=O)(=O)CC1=NOC2=CC=CC=C12

CAS 68291-97-4
Molecular Weight (g/mol) 212.22
MDL Number MFCD00865316
SMILES NS(=O)(=O)CC1=NOC2=CC=CC=C12
IUPAC Name (1,2-benzoxazol-3-yl)methanesulfonamide
InChI Key UBQNRHZMVUUOMG-UHFFFAOYSA-N
Molecular Formula C8H8N2O3S
8

4-Methoxy-1,2-benzisoxazol-3-amine, 97%, Thermo Scientific™

CAS: 177995-40-3 Molecular Formula: C8H8N2O2 Molecular Weight (g/mol): 164.164 MDL Number: MFCD03407354 InChI Key: YFNIGSJHKGKXEQ-UHFFFAOYSA-N Synonym: 4-methoxy-1,2-benzisoxazol-3-amine,4-methoxybenzo d isoxazol-3-amine,4-methoxy-benzo d isoxazol-3-ylamine,3-amino-4-methoxy-1,2-benzisoxazole,1,2-benzisoxazol-3-amine, 4-methoxy,maybridge3_004235,4-methoxybenzo d isoxazol-3-ylamine,4-methoxy-1,2-benzisoazole-3-amine,4-methoxybenzo d isoxazole-3-ylamine,4-methoxy-1,2-benzisoxazole-3-amine PubChem CID: 2779751 IUPAC Name: 4-methoxy-1,2-benzoxazol-3-amine SMILES: COC1=CC=CC2=C1C(=NO2)N

PubChem CID 2779751
CAS 177995-40-3
Molecular Weight (g/mol) 164.164
MDL Number MFCD03407354
SMILES COC1=CC=CC2=C1C(=NO2)N
Synonym 4-methoxy-1,2-benzisoxazol-3-amine,4-methoxybenzo d isoxazol-3-amine,4-methoxy-benzo d isoxazol-3-ylamine,3-amino-4-methoxy-1,2-benzisoxazole,1,2-benzisoxazol-3-amine, 4-methoxy,maybridge3_004235,4-methoxybenzo d isoxazol-3-ylamine,4-methoxy-1,2-benzisoazole-3-amine,4-methoxybenzo d isoxazole-3-ylamine,4-methoxy-1,2-benzisoxazole-3-amine
IUPAC Name 4-methoxy-1,2-benzoxazol-3-amine
InChI Key YFNIGSJHKGKXEQ-UHFFFAOYSA-N
Molecular Formula C8H8N2O2
9

1,2-Benzisoxazol-3-amine, 97%, Thermo Scientific™

CAS: 36216-80-5 Molecular Formula: C7H6N2O Molecular Weight (g/mol): 134.14 InChI Key: NLMVYUBGWZWUGB-UHFFFAOYSA-N Synonym: 1,2-benzisoxazol-3-amine,benzo d isoxazol-3-amine,3-amino-1,2-benzisoxazole,benzo d isoxazol-3-ylamine,1,2-benzoisoxazol-3-amine,benzo d isoxazole-3-ylamine,aminobenzisoxazole,amino-benzoisoxazole,zlchem 93,3-aminobenzisoxazole PubChem CID: 2779749 IUPAC Name: 1,2-benzoxazol-3-amine SMILES: C1=CC=C2C(=C1)C(=NO2)N

PubChem CID 2779749
CAS 36216-80-5
Molecular Weight (g/mol) 134.14
SMILES C1=CC=C2C(=C1)C(=NO2)N
Synonym 1,2-benzisoxazol-3-amine,benzo d isoxazol-3-amine,3-amino-1,2-benzisoxazole,benzo d isoxazol-3-ylamine,1,2-benzoisoxazol-3-amine,benzo d isoxazole-3-ylamine,aminobenzisoxazole,amino-benzoisoxazole,zlchem 93,3-aminobenzisoxazole
IUPAC Name 1,2-benzoxazol-3-amine
InChI Key NLMVYUBGWZWUGB-UHFFFAOYSA-N
Molecular Formula C7H6N2O
10

Zonisamide, Tocris Bioscience™

CAS: 68291-97-4 Molecular Formula: C8H8N2O3S Molecular Weight (g/mol): 212.22 MDL Number: MFCD00865316 InChI Key: UBQNRHZMVUUOMG-UHFFFAOYSA-N Synonym: zonisamide,zonegran,exceglan,excegram,1,2-benzisoxazole-3-methanesulfonamide,zonisamida,zonisamidum,zonisamidum latin,zonisamida spanish,excegran PubChem CID: 5734 ChEBI: CHEBI:10127 IUPAC Name: (1,2-benzoxazol-3-yl)methanesulfonamide SMILES: NS(=O)(=O)CC1=NOC2=CC=CC=C12

PubChem CID 5734
CAS 68291-97-4
Molecular Weight (g/mol) 212.22
ChEBI CHEBI:10127
MDL Number MFCD00865316
SMILES NS(=O)(=O)CC1=NOC2=CC=CC=C12
Synonym zonisamide,zonegran,exceglan,excegram,1,2-benzisoxazole-3-methanesulfonamide,zonisamida,zonisamidum,zonisamidum latin,zonisamida spanish,excegran
IUPAC Name (1,2-benzoxazol-3-yl)methanesulfonamide
InChI Key UBQNRHZMVUUOMG-UHFFFAOYSA-N
Molecular Formula C8H8N2O3S
11

3-(1-Acetyl-4-piperidinyl)-5-fluoro-1,2-benzisoxazole, 96%, Thermo Scientific™

CAS: 84163-10-0 Molecular Formula: C14H15FN2O2 Molecular Weight (g/mol): 262.284 MDL Number: MFCD06409291 InChI Key: PZNSVLCWHLHDLK-UHFFFAOYSA-N Synonym: 1-4-5-fluorobenzo d isoxazol-3-yl piperidin-1-yl ethanone,3-1-acetyl-4-piperidinyl-5-fluoro-1,2-benzisoxazole,piperidine, 1-acetyl-4-5-fluoro-1,2-benzisoxazol-3-yl,1-4-5-fluoro-1,2-benzoxazol-3-yl piperidin-1-yl ethanone,3-1-acetyl-4-piperidyl-5-fluoro-1,2-benzisoxazole,1-4-5-fluorobenzo d isoxazol-3-yl piperidin-1-yl ethan-1-one,1-4-5-fluoro-1,2-benzoxazol-3-yl piperidin-1-yl ethan-1-one PubChem CID: 13076420 IUPAC Name: 1-[4-(5-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethanone SMILES: CC(=O)N1CCC(CC1)C2=NOC3=C2C=C(C=C3)F

PubChem CID 13076420
CAS 84163-10-0
Molecular Weight (g/mol) 262.284
MDL Number MFCD06409291
SMILES CC(=O)N1CCC(CC1)C2=NOC3=C2C=C(C=C3)F
Synonym 1-4-5-fluorobenzo d isoxazol-3-yl piperidin-1-yl ethanone,3-1-acetyl-4-piperidinyl-5-fluoro-1,2-benzisoxazole,piperidine, 1-acetyl-4-5-fluoro-1,2-benzisoxazol-3-yl,1-4-5-fluoro-1,2-benzoxazol-3-yl piperidin-1-yl ethanone,3-1-acetyl-4-piperidyl-5-fluoro-1,2-benzisoxazole,1-4-5-fluorobenzo d isoxazol-3-yl piperidin-1-yl ethan-1-one,1-4-5-fluoro-1,2-benzoxazol-3-yl piperidin-1-yl ethan-1-one
IUPAC Name 1-[4-(5-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethanone
InChI Key PZNSVLCWHLHDLK-UHFFFAOYSA-N
Molecular Formula C14H15FN2O2