Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.

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9,916 – 9,930 of 104,965 results

9,916

Dimethyl Nitroterephthalate 97.0+%, TCI America™

CAS: 5292-45-5 Molecular Formula: C10H9NO6 Molecular Weight (g/mol): 239.18 MDL Number: MFCD00008422 InChI Key: PAYWCKGMOYQZAW-UHFFFAOYSA-N Synonym: dimethyl 2-nitroterephthalate,dimethyl nitroterephthalate,terephthalic acid, nitro-, dimethyl ester,unii-59qlu09dz4,1,4-benzenedicarboxylic acid, 2-nitro-, dimethyl ester,1,4-benzenedicarboxylic acid, 2-nitro-, 1,4-dimethyl ester,nitroterephthalic acid dimethyl ester,1,4-dimethyl 2-nitrobenzene-1,4-dicarboxylate,acmc-1aj3c,di-methyl nitroterephthalate PubChem CID: 21364 IUPAC Name: 1,4-dimethyl 2-nitrobenzene-1,4-dicarboxylate SMILES: COC(=O)C1=CC=C(C(=O)OC)C(=C1)[N+]([O-])=O

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Specifications

PubChem CID	21364
CAS	5292-45-5
Molecular Weight (g/mol)	239.18
MDL Number	MFCD00008422
SMILES	COC(=O)C1=CC=C(C(=O)OC)C(=C1)[N+]([O-])=O
Synonym	dimethyl 2-nitroterephthalate,dimethyl nitroterephthalate,terephthalic acid, nitro-, dimethyl ester,unii-59qlu09dz4,1,4-benzenedicarboxylic acid, 2-nitro-, dimethyl ester,1,4-benzenedicarboxylic acid, 2-nitro-, 1,4-dimethyl ester,nitroterephthalic acid dimethyl ester,1,4-dimethyl 2-nitrobenzene-1,4-dicarboxylate,acmc-1aj3c,di-methyl nitroterephthalate
IUPAC Name	1,4-dimethyl 2-nitrobenzene-1,4-dicarboxylate
InChI Key	PAYWCKGMOYQZAW-UHFFFAOYSA-N
Molecular Formula	C10H9NO6

9,917

Dimethyl 5-Nitroisophthalate, TCI America™

CAS: 13290-96-5 Molecular Formula: C10H9NO6 Molecular Weight (g/mol): 239.18 MDL Number: MFCD00008429 InChI Key: GGTSJKFPGKFLCZ-UHFFFAOYSA-N Synonym: dimethyl 5-nitroisophthalate,5-nitroisophthalic acid dimethyl ester,5-nitroisophthalic acid, dimethyl ester,1,3-benzenedicarboxylic acid, 5-nitro-, dimethyl ester,dimethyl 5-nitro-1,3-benzenedicarboxylate,isophthalic acid, 5-nitro-, dimethyl ester,1,3-dimethyl 5-nitrobenzene-1,3-dicarboxylate,5-nitro dimethyl isophthalate,5-nitro-1,3-benzenedicarboxylic acid dimethyl ester,1,3-benzenedicarboxylic acid, 5-nitro-, 1,3-dimethyl ester PubChem CID: 83316 IUPAC Name: 1,3-dimethyl 5-nitrobenzene-1,3-dicarboxylate SMILES: COC(=O)C1=CC(=CC(=C1)C(=O)OC)[N+]([O-])=O

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Specifications

PubChem CID	83316
CAS	13290-96-5
Molecular Weight (g/mol)	239.18
MDL Number	MFCD00008429
SMILES	COC(=O)C1=CC(=CC(=C1)C(=O)OC)[N+]([O-])=O
Synonym	dimethyl 5-nitroisophthalate,5-nitroisophthalic acid dimethyl ester,5-nitroisophthalic acid, dimethyl ester,1,3-benzenedicarboxylic acid, 5-nitro-, dimethyl ester,dimethyl 5-nitro-1,3-benzenedicarboxylate,isophthalic acid, 5-nitro-, dimethyl ester,1,3-dimethyl 5-nitrobenzene-1,3-dicarboxylate,5-nitro dimethyl isophthalate,5-nitro-1,3-benzenedicarboxylic acid dimethyl ester,1,3-benzenedicarboxylic acid, 5-nitro-, 1,3-dimethyl ester
IUPAC Name	1,3-dimethyl 5-nitrobenzene-1,3-dicarboxylate
InChI Key	GGTSJKFPGKFLCZ-UHFFFAOYSA-N
Molecular Formula	C10H9NO6

9,918

Monomethyl Terephthalate 98.0+%, TCI America™

CAS: 1679-64-7 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.159 MDL Number: MFCD00002557 InChI Key: REIDAMBAPLIATC-UHFFFAOYSA-N Synonym: 4-methoxycarbonyl benzoic acid,mono-methyl terephthalate,monomethyl terephthalate,methyl terephthalate,methyl hydrogen terephthalate,1,4-benzenedicarboxylic acid, monomethyl ester,terephthalic acid monomethyl ester,1,4-benzenedicarboxylic acid monomethyl ester,terephthalic acid, monomethyl ester,hydrogen methyl terephthalate PubChem CID: 15513 IUPAC Name: 4-methoxycarbonylbenzoic acid SMILES: COC(=O)C1=CC=C(C=C1)C(=O)O

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Specifications

PubChem CID	15513
CAS	1679-64-7
Molecular Weight (g/mol)	180.159
MDL Number	MFCD00002557
SMILES	COC(=O)C1=CC=C(C=C1)C(=O)O
Synonym	4-methoxycarbonyl benzoic acid,mono-methyl terephthalate,monomethyl terephthalate,methyl terephthalate,methyl hydrogen terephthalate,1,4-benzenedicarboxylic acid, monomethyl ester,terephthalic acid monomethyl ester,1,4-benzenedicarboxylic acid monomethyl ester,terephthalic acid, monomethyl ester,hydrogen methyl terephthalate
IUPAC Name	4-methoxycarbonylbenzoic acid
InChI Key	REIDAMBAPLIATC-UHFFFAOYSA-N
Molecular Formula	C9H8O4

9,919

2-Fluorophenol 98.0+%, TCI America™

CAS: 367-12-4 Molecular Formula: C6H5FO Molecular Weight (g/mol): 112.10 MDL Number: MFCD00002155 InChI Key: HFHFGHLXUCOHLN-UHFFFAOYSA-N Synonym: o-fluorophenol,phenol, 2-fluoro,phenol, o-fluoro,1-fluoro-2-hydroxybenzene,2-fluorohydroxybenzene,fluorophenol,unii-i9ow1nly9r,2-fluoro-phenol,phenol, fluoro,ccris 1226 PubChem CID: 9707 IUPAC Name: 2-fluorophenol SMILES: OC1=CC=CC=C1F

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Specifications

PubChem CID	9707
CAS	367-12-4
Molecular Weight (g/mol)	112.10
MDL Number	MFCD00002155
SMILES	OC1=CC=CC=C1F
Synonym	o-fluorophenol,phenol, 2-fluoro,phenol, o-fluoro,1-fluoro-2-hydroxybenzene,2-fluorohydroxybenzene,fluorophenol,unii-i9ow1nly9r,2-fluoro-phenol,phenol, fluoro,ccris 1226
IUPAC Name	2-fluorophenol
InChI Key	HFHFGHLXUCOHLN-UHFFFAOYSA-N
Molecular Formula	C6H5FO

9,920

2-Chloro-4-fluoro-5-nitrophenol 98.0+%, TCI America™

CAS: 84478-75-1 Molecular Formula: C6H3ClFNO3 Molecular Weight (g/mol): 191.54 MDL Number: MFCD02670258 InChI Key: NAWVMCKMQMJQMF-UHFFFAOYSA-N Synonym: 2-chloro-4-fluoro-5-nitrobenzenol,phenol, 2-chloro-4-fluoro-5-nitro,2-chloro-4-fluoro-5-nitro-phenol,pubchem2849,chlorofluoronitrobenzenol,acmc-1bkdg,ksc495s7h,2-fluoro-4-chloro-5-hydroxynitrobenzene,4-chloro-2-fluoro-5-hydroxy-1-nitrobenzene PubChem CID: 158655 IUPAC Name: 2-chloro-4-fluoro-5-nitrophenol SMILES: OC1=CC(=C(F)C=C1Cl)[N+]([O-])=O

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Specifications

PubChem CID	158655
CAS	84478-75-1
Molecular Weight (g/mol)	191.54
MDL Number	MFCD02670258
SMILES	OC1=CC(=C(F)C=C1Cl)[N+]([O-])=O
Synonym	2-chloro-4-fluoro-5-nitrobenzenol,phenol, 2-chloro-4-fluoro-5-nitro,2-chloro-4-fluoro-5-nitro-phenol,pubchem2849,chlorofluoronitrobenzenol,acmc-1bkdg,ksc495s7h,2-fluoro-4-chloro-5-hydroxynitrobenzene,4-chloro-2-fluoro-5-hydroxy-1-nitrobenzene
IUPAC Name	2-chloro-4-fluoro-5-nitrophenol
InChI Key	NAWVMCKMQMJQMF-UHFFFAOYSA-N
Molecular Formula	C6H3ClFNO3

9,921

4-Chloro-3-nitrophenol 98.0+%, TCI America™

CAS: 610-78-6 Molecular Formula: C6H4ClNO3 Molecular Weight (g/mol): 173.552 MDL Number: MFCD00043546 InChI Key: JUIKCULGDIZNDI-UHFFFAOYSA-N Synonym: phenol, 4-chloro-3-nitro,4-chloro-3-nitro-phenol,4chloro-3-nitrophenol,pubchem10459,4-chlor-3-nitro-phenol,3-nitro-4-chloro phenol,acmc-1azj5,phenol,4-chloro-3-nitro,4-chloranyl-3-nitro-phenol,2-chloro-5-hydroxy nitrobenzene PubChem CID: 69127 IUPAC Name: 4-chloro-3-nitrophenol SMILES: C1=CC(=C(C=C1O)[N+](=O)[O-])Cl

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Specifications

PubChem CID	69127
CAS	610-78-6
Molecular Weight (g/mol)	173.552
MDL Number	MFCD00043546
SMILES	C1=CC(=C(C=C1O)[N+](=O)[O-])Cl
Synonym	phenol, 4-chloro-3-nitro,4-chloro-3-nitro-phenol,4chloro-3-nitrophenol,pubchem10459,4-chlor-3-nitro-phenol,3-nitro-4-chloro phenol,acmc-1azj5,phenol,4-chloro-3-nitro,4-chloranyl-3-nitro-phenol,2-chloro-5-hydroxy nitrobenzene
IUPAC Name	4-chloro-3-nitrophenol
InChI Key	JUIKCULGDIZNDI-UHFFFAOYSA-N
Molecular Formula	C6H4ClNO3

9,922

3-Chloro-4-hydroxybenzonitrile 98.0+%, TCI America™

CAS: 2315-81-3 Molecular Formula: C7H4ClNO Molecular Weight (g/mol): 153.565 MDL Number: MFCD01567246 InChI Key: CRYPJUOSZDQWJZ-UHFFFAOYSA-N Synonym: benzonitrile, 3-chloro-4-hydroxy,2-chloro-4-cyanophenol,3-chloro-4-hydroxy-benzonitrile,3-chloro-4-hydroxybenzenecarbonitrile,pubchem4726,4-cyano-2-chlorophenol,buttpark 4357-94,acmc-1clj1,pharmabridge p-1867,buttpark 43\57-94 PubChem CID: 2735739 IUPAC Name: 3-chloro-4-hydroxybenzonitrile SMILES: C1=CC(=C(C=C1C#N)Cl)O

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Specifications

PubChem CID	2735739
CAS	2315-81-3
Molecular Weight (g/mol)	153.565
MDL Number	MFCD01567246
SMILES	C1=CC(=C(C=C1C#N)Cl)O
Synonym	benzonitrile, 3-chloro-4-hydroxy,2-chloro-4-cyanophenol,3-chloro-4-hydroxy-benzonitrile,3-chloro-4-hydroxybenzenecarbonitrile,pubchem4726,4-cyano-2-chlorophenol,buttpark 4357-94,acmc-1clj1,pharmabridge p-1867,buttpark 43\57-94
IUPAC Name	3-chloro-4-hydroxybenzonitrile
InChI Key	CRYPJUOSZDQWJZ-UHFFFAOYSA-N
Molecular Formula	C7H4ClNO

9,923

4-Bromo-2-nitrophenol 98.0+%, TCI America™

CAS: 7693-52-9 Molecular Formula: C6H4BrNO3 Molecular Weight (g/mol): 218.01 MDL Number: MFCD00082540 InChI Key: CUTFAPGINUFNQM-UHFFFAOYSA-N Synonym: 2-nitro-4-bromophenol,phenol, 4-bromo-2-nitro,4-bromo-2-nitro-phenol,4-bromo-1-hydroxy-2-nitrobenzene,phenol, 2-nitro-5-bromo,pubchem4099,4-brom-2-nitro-phenol,acmc-209p6y,4-06-00-01363 beilstein handbook reference,ksc494e2j PubChem CID: 24364 IUPAC Name: 4-bromo-2-nitrophenol SMILES: OC1=CC=C(Br)C=C1[N+]([O-])=O

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Specifications

PubChem CID	24364
CAS	7693-52-9
Molecular Weight (g/mol)	218.01
MDL Number	MFCD00082540
SMILES	OC1=CC=C(Br)C=C1[N+]([O-])=O
Synonym	2-nitro-4-bromophenol,phenol, 4-bromo-2-nitro,4-bromo-2-nitro-phenol,4-bromo-1-hydroxy-2-nitrobenzene,phenol, 2-nitro-5-bromo,pubchem4099,4-brom-2-nitro-phenol,acmc-209p6y,4-06-00-01363 beilstein handbook reference,ksc494e2j
IUPAC Name	4-bromo-2-nitrophenol
InChI Key	CUTFAPGINUFNQM-UHFFFAOYSA-N
Molecular Formula	C6H4BrNO3

9,924

2-Chloro-5-nitrophenol 98.0+%, TCI America™

CAS: 619-10-3 Molecular Formula: C6H4ClNO3 Molecular Weight (g/mol): 173.55 MDL Number: MFCD01571825 InChI Key: BUMGQSCPTLELLS-UHFFFAOYSA-N Synonym: phenol, 2-chloro-5-nitro,6-chloro-3-nitrophenol,2-chloro-5-nitro-phenol,pubchem1475,acmc-209mxh,2-chloro-5-nitrofenol,5-nitro-2-chlorophenol,2-chloro-5-nitro phenol,ksc494c3h,4-chloro-3-hydroxynitrobenzene PubChem CID: 69264 IUPAC Name: 2-chloro-5-nitrophenol SMILES: OC1=CC(=CC=C1Cl)[N+]([O-])=O

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Specifications

PubChem CID	69264
CAS	619-10-3
Molecular Weight (g/mol)	173.55
MDL Number	MFCD01571825
SMILES	OC1=CC(=CC=C1Cl)[N+]([O-])=O
Synonym	phenol, 2-chloro-5-nitro,6-chloro-3-nitrophenol,2-chloro-5-nitro-phenol,pubchem1475,acmc-209mxh,2-chloro-5-nitrofenol,5-nitro-2-chlorophenol,2-chloro-5-nitro phenol,ksc494c3h,4-chloro-3-hydroxynitrobenzene
IUPAC Name	2-chloro-5-nitrophenol
InChI Key	BUMGQSCPTLELLS-UHFFFAOYSA-N
Molecular Formula	C6H4ClNO3

9,925

(R)-3,3'-Dibromo-1,1'-bi-2-naphthol 98.0+%, TCI America™

CAS: 111795-43-8 Molecular Formula: C20H12Br2O2 Molecular Weight (g/mol): 444.122 MDL Number: MFCD03093629 InChI Key: BRTBEAXHUYEXSY-UHFFFAOYSA-N Synonym: s---3,3'-dibromo-1,1'-bi-2-naphthol,r-3,3'-dibromo-1,1'-bi-2-naphthol,r-+-3,3'-dibromo-1,1'-bi-2-naphthol,s-3,3'-dibromo-1,1'-bi-2-naphthol,s-dibromo-1,1-binaphthol,r-dibromo-binol,s-dibromo-binol,r-dibromo-bi-2-naphthol,s-dibromo-bi-2-naphthol,r-dibromo-1,1-binaphthol PubChem CID: 10765693 IUPAC Name: 3-bromo-1-(3-bromo-2-hydroxynaphthalen-1-yl)naphthalen-2-ol SMILES: C1=CC=C2C(=C1)C=C(C(=C2C3=C(C(=CC4=CC=CC=C43)Br)O)O)Br

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Specifications

PubChem CID	10765693
CAS	111795-43-8
Molecular Weight (g/mol)	444.122
MDL Number	MFCD03093629
SMILES	C1=CC=C2C(=C1)C=C(C(=C2C3=C(C(=CC4=CC=CC=C43)Br)O)O)Br
Synonym	s---3,3'-dibromo-1,1'-bi-2-naphthol,r-3,3'-dibromo-1,1'-bi-2-naphthol,r-+-3,3'-dibromo-1,1'-bi-2-naphthol,s-3,3'-dibromo-1,1'-bi-2-naphthol,s-dibromo-1,1-binaphthol,r-dibromo-binol,s-dibromo-binol,r-dibromo-bi-2-naphthol,s-dibromo-bi-2-naphthol,r-dibromo-1,1-binaphthol
IUPAC Name	3-bromo-1-(3-bromo-2-hydroxynaphthalen-1-yl)naphthalen-2-ol
InChI Key	BRTBEAXHUYEXSY-UHFFFAOYSA-N
Molecular Formula	C20H12Br2O2

9,926

3-Chloro-5-hydroxybenzonitrile 95.0+%, TCI America™

CAS: 473923-97-6 Molecular Formula: C7H4ClNO Molecular Weight (g/mol): 153.57 MDL Number: MFCD11226540 InChI Key: GHYUOOZZOMUNSY-UHFFFAOYSA-N Synonym: 3-Chloro-5-cyanophenol PubChem CID: 21949878 IUPAC Name: 3-chloro-5-hydroxybenzonitrile SMILES: OC1=CC(Cl)=CC(=C1)C#N

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Specifications

PubChem CID	21949878
CAS	473923-97-6
Molecular Weight (g/mol)	153.57
MDL Number	MFCD11226540
SMILES	OC1=CC(Cl)=CC(=C1)C#N
Synonym	3-Chloro-5-cyanophenol
IUPAC Name	3-chloro-5-hydroxybenzonitrile
InChI Key	GHYUOOZZOMUNSY-UHFFFAOYSA-N
Molecular Formula	C7H4ClNO

9,927

3-Bromo-4-fluorophenol 99.0+%, TCI America™

CAS: 27407-11-0 Molecular Formula: C6H4BrFO Molecular Weight (g/mol): 190.999 MDL Number: MFCD03425884 InChI Key: QWTULQLVGNZMLF-UHFFFAOYSA-N Synonym: 3-bromo-4-fluoro-phenol,phenol, 3-bromo-4-fluoro,pubchem1486,acmc-1cmha,ksc201s9b,3-bromanyl-4-fluoranyl-phenol PubChem CID: 2783381 IUPAC Name: 3-bromo-4-fluorophenol SMILES: C1=CC(=C(C=C1O)Br)F

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Specifications

PubChem CID	2783381
CAS	27407-11-0
Molecular Weight (g/mol)	190.999
MDL Number	MFCD03425884
SMILES	C1=CC(=C(C=C1O)Br)F
Synonym	3-bromo-4-fluoro-phenol,phenol, 3-bromo-4-fluoro,pubchem1486,acmc-1cmha,ksc201s9b,3-bromanyl-4-fluoranyl-phenol
IUPAC Name	3-bromo-4-fluorophenol
InChI Key	QWTULQLVGNZMLF-UHFFFAOYSA-N
Molecular Formula	C6H4BrFO

9,928

4-Hydroxybenzenesulfonamide 97.0+%, TCI America™

CAS: 1576-43-8 Molecular Formula: C6H7NO3S Molecular Weight (g/mol): 173.186 MDL Number: MFCD00059190 InChI Key: DIRCLGLKRZLKHG-UHFFFAOYSA-N Synonym: p-hydroxybenzenesulfonamide,p-phenolsulfonamide,benzenesulfonamide, 4-hydroxy,4-sulfamoylphenol,benzenesulfonamide, p-hydroxy,4-hydroxyphenylsulfonamide,unii-1iit7r7vpj,p-hydroxybenzenesulphonamide,4-hydroxybenzenesulphonamide,4-hydroxybenzene-1-sulfonamide PubChem CID: 74093 IUPAC Name: 4-hydroxybenzenesulfonamide SMILES: C1=CC(=CC=C1O)S(=O)(=O)N

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Specifications

PubChem CID	74093
CAS	1576-43-8
Molecular Weight (g/mol)	173.186
MDL Number	MFCD00059190
SMILES	C1=CC(=CC=C1O)S(=O)(=O)N
Synonym	p-hydroxybenzenesulfonamide,p-phenolsulfonamide,benzenesulfonamide, 4-hydroxy,4-sulfamoylphenol,benzenesulfonamide, p-hydroxy,4-hydroxyphenylsulfonamide,unii-1iit7r7vpj,p-hydroxybenzenesulphonamide,4-hydroxybenzenesulphonamide,4-hydroxybenzene-1-sulfonamide
IUPAC Name	4-hydroxybenzenesulfonamide
InChI Key	DIRCLGLKRZLKHG-UHFFFAOYSA-N
Molecular Formula	C6H7NO3S

9,929

N-(p-Toluenesulfonyl)glycine 98.0+%, TCI America™

CAS: 1080-44-0 Molecular Formula: C9H11NO4S Molecular Weight (g/mol): 229.25 MDL Number: MFCD00045898 InChI Key: VDKFCCZUCXYILI-UHFFFAOYSA-N Synonym: n-p-tosylglycine,tos-gly-oh,n-tosylglycine,2-4-methylphenylsulfonamido acetic acid,n-4-methylphenyl sulfonyl glycine,n-p-toluenesulfonyl glycine,n-4-tosylglycine,glycine, n-4-methylphenyl sulfonyl,n-toluene-4-sulfonyl-glycine,toluene-4-sulfonylamino-acetic acid PubChem CID: 70653 IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]acetic acid SMILES: CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)O

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Specifications

PubChem CID	70653
CAS	1080-44-0
Molecular Weight (g/mol)	229.25
MDL Number	MFCD00045898
SMILES	CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)O
Synonym	n-p-tosylglycine,tos-gly-oh,n-tosylglycine,2-4-methylphenylsulfonamido acetic acid,n-4-methylphenyl sulfonyl glycine,n-p-toluenesulfonyl glycine,n-4-tosylglycine,glycine, n-4-methylphenyl sulfonyl,n-toluene-4-sulfonyl-glycine,toluene-4-sulfonylamino-acetic acid
IUPAC Name	2-[(4-methylphenyl)sulfonylamino]acetic acid
InChI Key	VDKFCCZUCXYILI-UHFFFAOYSA-N
Molecular Formula	C9H11NO4S

9,930

Benzenesulfonamide 98.0+%, TCI America™

CAS: 98-10-2 Molecular Formula: C6H7NO2S Molecular Weight (g/mol): 157.187 MDL Number: MFCD00007930 InChI Key: KHBQMWCZKVMBLN-UHFFFAOYSA-N Synonym: benzenesulphonamide,benzosulfonamide,benzolsulfonamide,phenyl sulfonamide,benzene sulfonamide,phenylsulfonamide,m and b 7973,chembl27601,benzolsulfonamid,benzensulfonamide PubChem CID: 7370 IUPAC Name: benzenesulfonamide SMILES: C1=CC=C(C=C1)S(=O)(=O)N

Pricing & Availability
Specifications

PubChem CID	7370
CAS	98-10-2
Molecular Weight (g/mol)	157.187
MDL Number	MFCD00007930
SMILES	C1=CC=C(C=C1)S(=O)(=O)N
Synonym	benzenesulphonamide,benzosulfonamide,benzolsulfonamide,phenyl sulfonamide,benzene sulfonamide,phenylsulfonamide,m and b 7973,chembl27601,benzolsulfonamid,benzensulfonamide
IUPAC Name	benzenesulfonamide
InChI Key	KHBQMWCZKVMBLN-UHFFFAOYSA-N
Molecular Formula	C6H7NO2S

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Benzenoids

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