Benzene and substituted derivatives
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N-α-Benzoyl-L-Arginine p-Nitroanilide Hydrochloride, MP Biomedicals™
CAS: 21653-40-7 Molecular Formula: C19H23ClN6O4 Molecular Weight (g/mol): 434.881 MDL Number: MFCD00063682 InChI Key: DEOKFPFLXFNAON-NTISSMGPSA-N Synonym: bz-arg-pna.hcl,s-n-5-guanidino-1-4-nitrophenyl amino-1-oxopentan-2-yl benzamide hydrochloride,nalpha-benzoyl-l-arginine 4-nitroanilide hydrochloride,bani,s-5-amidinoamino-2-benzoylamino-n-4-nitrophenyl valeramide monohydrochloride,l-bapna,2s-5-carbamimidamido-n-4-nitrophenyl-2-phenylformamido pentanamide hydrochloride,bz-arg-pna-hcl,bz-arg-pna hcl,bz-arg-pna . hcl PubChem CID: 16219022 IUPAC Name: N-[(2S)-5-(diaminomethylideneamino)-1-(4-nitroanilino)-1-oxopentan-2-yl]benzamide;hydrochloride SMILES: C1=CC=C(C=C1)C(=O)NC(CCCN=C(N)N)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-].Cl
| PubChem CID | 16219022 |
|---|---|
| CAS | 21653-40-7 |
| Molecular Weight (g/mol) | 434.881 |
| MDL Number | MFCD00063682 |
| SMILES | C1=CC=C(C=C1)C(=O)NC(CCCN=C(N)N)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-].Cl |
| Synonym | bz-arg-pna.hcl,s-n-5-guanidino-1-4-nitrophenyl amino-1-oxopentan-2-yl benzamide hydrochloride,nalpha-benzoyl-l-arginine 4-nitroanilide hydrochloride,bani,s-5-amidinoamino-2-benzoylamino-n-4-nitrophenyl valeramide monohydrochloride,l-bapna,2s-5-carbamimidamido-n-4-nitrophenyl-2-phenylformamido pentanamide hydrochloride,bz-arg-pna-hcl,bz-arg-pna hcl,bz-arg-pna . hcl |
| IUPAC Name | N-[(2S)-5-(diaminomethylideneamino)-1-(4-nitroanilino)-1-oxopentan-2-yl]benzamide;hydrochloride |
| InChI Key | DEOKFPFLXFNAON-NTISSMGPSA-N |
| Molecular Formula | C19H23ClN6O4 |
2-Fluoro-4-nitrotoluene, 98%
CAS: 1427-07-2 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.128 MDL Number: MFCD00007199 InChI Key: WIQISTBTOQNVCE-UHFFFAOYSA-N Synonym: 2-fluoro-4-nitrotoluene,toluene, 2-fluoro-4-nitro,benzene, 2-fluoro-1-methyl-4-nitro,3-fluoro-4-methylnitrobenzene,1-methyl-2-fluoro-4-nitrobenzene,2-fluoro-1-methyl-4-nitro-benzene,pubchem1592,2-fluoro4-nitrotoluene,acmc-209cov,2-fluor-4-nitro-toluol PubChem CID: 74025 IUPAC Name: 2-fluoro-1-methyl-4-nitrobenzene SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])F
| PubChem CID | 74025 |
|---|---|
| CAS | 1427-07-2 |
| Molecular Weight (g/mol) | 155.128 |
| MDL Number | MFCD00007199 |
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])F |
| Synonym | 2-fluoro-4-nitrotoluene,toluene, 2-fluoro-4-nitro,benzene, 2-fluoro-1-methyl-4-nitro,3-fluoro-4-methylnitrobenzene,1-methyl-2-fluoro-4-nitrobenzene,2-fluoro-1-methyl-4-nitro-benzene,pubchem1592,2-fluoro4-nitrotoluene,acmc-209cov,2-fluor-4-nitro-toluol |
| IUPAC Name | 2-fluoro-1-methyl-4-nitrobenzene |
| InChI Key | WIQISTBTOQNVCE-UHFFFAOYSA-N |
| Molecular Formula | C7H6FNO2 |
LiChropur™ ™-(-)-α-Methoxy-α-(trifluoromethyl)phenylacetyl chloride, 99.0%, MilliporeSigma™ Supelco™
Molecular Formula: C10H8ClF3O2 Molecular Weight (g/mol): 252.62 MDL Number: MFCD00044400 InChI Key: PAORVUMOXXAMPL-VIFPVBQESA-N Synonym: (R)-(-)-MTPA-Cl; Mosher's acid chloride IUPAC Name: (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride SMILES: CO[C@](C(Cl)=O)(C1=CC=CC=C1)C(F)(F)F
| Molecular Weight (g/mol) | 252.62 |
|---|---|
| MDL Number | MFCD00044400 |
| SMILES | CO[C@](C(Cl)=O)(C1=CC=CC=C1)C(F)(F)F |
| Synonym | (R)-(-)-MTPA-Cl; Mosher's acid chloride |
| IUPAC Name | (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride |
| InChI Key | PAORVUMOXXAMPL-VIFPVBQESA-N |
| Molecular Formula | C10H8ClF3O2 |
2,4-Difluoromandelic acid, 97%
CAS: 132741-30-1 Molecular Formula: C8H6F2O3 Molecular Weight (g/mol): 188.13 MDL Number: MFCD00061296 InChI Key: RRRQFGNNRJHLNV-UHFFFAOYSA-N Synonym: 2,4-difluoromandelic acid,2-2,4-difluorophenyl-2-hydroxyacetic acid,2,4-difluorophenyl hydroxy acetic acid,2,4-difluoro mandelic acid,2,4-difluoro-a-hydroxyphenylacetic acid,alpha-hydroxy-2,4-difluorophenylacetic acid,2,4-difluorophenyl hydroxy acetic acid #,2,4-difluoro-alpha-hydroxybenzeneacetic acid,currency-hydroxy-2,4-difluorophenylacetic acid PubChem CID: 588651 IUPAC Name: 2-(2,4-difluorophenyl)-2-hydroxyacetic acid SMILES: C1=CC(=C(C=C1F)F)C(C(=O)O)O
| PubChem CID | 588651 |
|---|---|
| CAS | 132741-30-1 |
| Molecular Weight (g/mol) | 188.13 |
| MDL Number | MFCD00061296 |
| SMILES | C1=CC(=C(C=C1F)F)C(C(=O)O)O |
| Synonym | 2,4-difluoromandelic acid,2-2,4-difluorophenyl-2-hydroxyacetic acid,2,4-difluorophenyl hydroxy acetic acid,2,4-difluoro mandelic acid,2,4-difluoro-a-hydroxyphenylacetic acid,alpha-hydroxy-2,4-difluorophenylacetic acid,2,4-difluorophenyl hydroxy acetic acid #,2,4-difluoro-alpha-hydroxybenzeneacetic acid,currency-hydroxy-2,4-difluorophenylacetic acid |
| IUPAC Name | 2-(2,4-difluorophenyl)-2-hydroxyacetic acid |
| InChI Key | RRRQFGNNRJHLNV-UHFFFAOYSA-N |
| Molecular Formula | C8H6F2O3 |
4-Amino-3-methoxybenzoic acid, 98%
CAS: 2486-69-3 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.16 MDL Number: MFCD00016539 InChI Key: JNFGLYJROFAOQP-UHFFFAOYSA-N Synonym: 4-amino-3-methoxy-benzoic acid,3-methoxy-4-aminobenzoic acid,4-amino-m-anisic acid,benzoic acid, 4-amino-3-methoxy,o-anisidine-4-carboxylic acid,4-amino-3-methoxy benzoic acid,timtec-bb sbb008622,4-amino-3-methoxybenzoic,4-amino-3-methoxybenzoic acid,4-amino-3-methoxybenzoicacid PubChem CID: 288057 IUPAC Name: 4-amino-3-methoxybenzoic acid SMILES: COC1=C(C=CC(=C1)C(=O)O)N
| PubChem CID | 288057 |
|---|---|
| CAS | 2486-69-3 |
| Molecular Weight (g/mol) | 167.16 |
| MDL Number | MFCD00016539 |
| SMILES | COC1=C(C=CC(=C1)C(=O)O)N |
| Synonym | 4-amino-3-methoxy-benzoic acid,3-methoxy-4-aminobenzoic acid,4-amino-m-anisic acid,benzoic acid, 4-amino-3-methoxy,o-anisidine-4-carboxylic acid,4-amino-3-methoxy benzoic acid,timtec-bb sbb008622,4-amino-3-methoxybenzoic,4-amino-3-methoxybenzoic acid,4-amino-3-methoxybenzoicacid |
| IUPAC Name | 4-amino-3-methoxybenzoic acid |
| InChI Key | JNFGLYJROFAOQP-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO3 |
4-(Trifluoromethoxy)aniline, 98%
CAS: 461-82-5 Molecular Formula: C7H6F3NO Molecular Weight (g/mol): 177.126 MDL Number: MFCD00041314 InChI Key: XUJFOSLZQITUOI-UHFFFAOYSA-N Synonym: 4-trifluoromethoxy aniline,4-trifluoromethoxy-phenylamine,4-trifluoromethoxy benzenamine,p-trifluoromethoxyaniline,4-trifluoroethoxy aniline,benzenamine, 4-trifluoromethoxy,unii-p40l42cvf6,alpha,alpha,alpha-trifluoro-p-anisidine,p-aminotrifluoromethoxybenzene,4-amino-alpha,alpha,alpha-trifluoroanisole PubChem CID: 600848 IUPAC Name: 4-(trifluoromethoxy)aniline SMILES: C1=CC(=CC=C1N)OC(F)(F)F
| PubChem CID | 600848 |
|---|---|
| CAS | 461-82-5 |
| Molecular Weight (g/mol) | 177.126 |
| MDL Number | MFCD00041314 |
| SMILES | C1=CC(=CC=C1N)OC(F)(F)F |
| Synonym | 4-trifluoromethoxy aniline,4-trifluoromethoxy-phenylamine,4-trifluoromethoxy benzenamine,p-trifluoromethoxyaniline,4-trifluoroethoxy aniline,benzenamine, 4-trifluoromethoxy,unii-p40l42cvf6,alpha,alpha,alpha-trifluoro-p-anisidine,p-aminotrifluoromethoxybenzene,4-amino-alpha,alpha,alpha-trifluoroanisole |
| IUPAC Name | 4-(trifluoromethoxy)aniline |
| InChI Key | XUJFOSLZQITUOI-UHFFFAOYSA-N |
| Molecular Formula | C7H6F3NO |
Bis[(2-diphenylphosphino)phenyl] ether, 98%
CAS: 166330-10-5 Molecular Formula: C36H28OP2 Molecular Weight (g/mol): 538.57 MDL Number: MFCD00233863 InChI Key: RYXZOQOZERSHHQ-UHFFFAOYSA-N Synonym: bis 2-diphenylphosphinophenyl ether,dpephos,oxydi-2,1-phenylene bis diphenylphosphine,oxybis 2,1-phenylene bis diphenylphosphine,bis 2-diphenylphosphino phenyl ether,2,2'-bis diphenylphosphino diphenyl ether,2-2-diphenylphosphanyl phenoxy phenyl diphenylphosphane PubChem CID: 4285986 IUPAC Name: [2-(2-diphenylphosphanylphenoxy)phenyl]-diphenylphosphane SMILES: O(C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 4285986 |
|---|---|
| CAS | 166330-10-5 |
| Molecular Weight (g/mol) | 538.57 |
| MDL Number | MFCD00233863 |
| SMILES | O(C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | bis 2-diphenylphosphinophenyl ether,dpephos,oxydi-2,1-phenylene bis diphenylphosphine,oxybis 2,1-phenylene bis diphenylphosphine,bis 2-diphenylphosphino phenyl ether,2,2'-bis diphenylphosphino diphenyl ether,2-2-diphenylphosphanyl phenoxy phenyl diphenylphosphane |
| IUPAC Name | [2-(2-diphenylphosphanylphenoxy)phenyl]-diphenylphosphane |
| InChI Key | RYXZOQOZERSHHQ-UHFFFAOYSA-N |
| Molecular Formula | C36H28OP2 |
Diphenhydramine hydrochloride, 99%, Thermo Scientific Chemicals
CAS: 147-24-0 Molecular Formula: C17H22ClNO Molecular Weight (g/mol): 291.82 MDL Number: MFCD00012479 InChI Key: PCHPORCSPXIHLZ-UHFFFAOYSA-N Synonym: diphenhydramine hydrochloride,dimedrol,diphenhydramine hcl,carphenamine,bendylate,carphenex,cathejell,denydryl,diphamine,eldadryl PubChem CID: 8980 ChEBI: CHEBI:4637 IUPAC Name: hydrogen [2-(diphenylmethoxy)ethyl]dimethylamine chloride SMILES: [H+].[Cl-].CN(C)CCOC(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 8980 |
|---|---|
| CAS | 147-24-0 |
| Molecular Weight (g/mol) | 291.82 |
| ChEBI | CHEBI:4637 |
| MDL Number | MFCD00012479 |
| SMILES | [H+].[Cl-].CN(C)CCOC(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | diphenhydramine hydrochloride,dimedrol,diphenhydramine hcl,carphenamine,bendylate,carphenex,cathejell,denydryl,diphamine,eldadryl |
| IUPAC Name | hydrogen [2-(diphenylmethoxy)ethyl]dimethylamine chloride |
| InChI Key | PCHPORCSPXIHLZ-UHFFFAOYSA-N |
| Molecular Formula | C17H22ClNO |
2-Chloro-4-(dimethylamino)benzaldehyde, ≥95%, Thermo Scientific™
CAS: 1424-66-4 Molecular Formula: C9H10ClNO Molecular Weight (g/mol): 183.64 MDL Number: MFCD00021051 InChI Key: XSQFAWMDRFSIMY-UHFFFAOYSA-N Synonym: 2-chloro-4-dimethylamino benzaldehyde,benzaldehyde, 2-chloro-4-dimethylamino,benzaldehyde,2-chloro-4-dimethylamino,2-chloro-4-n,n-bis methyl amino benzaldehyde,4-dimethylamino-2-chlorobenzaldehyde,acmc-209coh,3-chloro-n,n-dimethyl-4-formylaniline PubChem CID: 74021 IUPAC Name: 2-chloro-4-(dimethylamino)benzaldehyde SMILES: CN(C)C1=CC=C(C=O)C(Cl)=C1
| PubChem CID | 74021 |
|---|---|
| CAS | 1424-66-4 |
| Molecular Weight (g/mol) | 183.64 |
| MDL Number | MFCD00021051 |
| SMILES | CN(C)C1=CC=C(C=O)C(Cl)=C1 |
| Synonym | 2-chloro-4-dimethylamino benzaldehyde,benzaldehyde, 2-chloro-4-dimethylamino,benzaldehyde,2-chloro-4-dimethylamino,2-chloro-4-n,n-bis methyl amino benzaldehyde,4-dimethylamino-2-chlorobenzaldehyde,acmc-209coh,3-chloro-n,n-dimethyl-4-formylaniline |
| IUPAC Name | 2-chloro-4-(dimethylamino)benzaldehyde |
| InChI Key | XSQFAWMDRFSIMY-UHFFFAOYSA-N |
| Molecular Formula | C9H10ClNO |
4-Aminophthalic acid, 98%
CAS: 5434-21-9 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00013985 InChI Key: OXSANYRLJHSQEP-UHFFFAOYSA-N Synonym: 4-aminobenzene-1,2-dicarboxylic acid,1,2-benzenedicarboxylic acid, 4-amino,4-amino-1,2-benzenedicarboxylic acid,4-amino phthalic acid,contains 3-aminophthalic acid,pubchem16853,acmc-1arqu,4-aminophthalic acid,ksc270i4n,ghl.pd_mitscher_leg0.1208 PubChem CID: 72912 IUPAC Name: 4-aminophthalic acid SMILES: C1=CC(=C(C=C1N)C(=O)O)C(=O)O
| PubChem CID | 72912 |
|---|---|
| CAS | 5434-21-9 |
| Molecular Weight (g/mol) | 181.147 |
| MDL Number | MFCD00013985 |
| SMILES | C1=CC(=C(C=C1N)C(=O)O)C(=O)O |
| Synonym | 4-aminobenzene-1,2-dicarboxylic acid,1,2-benzenedicarboxylic acid, 4-amino,4-amino-1,2-benzenedicarboxylic acid,4-amino phthalic acid,contains 3-aminophthalic acid,pubchem16853,acmc-1arqu,4-aminophthalic acid,ksc270i4n,ghl.pd_mitscher_leg0.1208 |
| IUPAC Name | 4-aminophthalic acid |
| InChI Key | OXSANYRLJHSQEP-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO4 |
Cinnamonitrile, 97%, predominantly trans
CAS: 1885-38-7 Molecular Formula: C9H7N Molecular Weight (g/mol): 129.162 MDL Number: MFCD00001930 InChI Key: ZWKNLRXFUTWSOY-QPJJXVBHSA-N Synonym: cinnamonitrile,trans-cinnamonitrile,styryl cyanide,cinnamyl nitrile,3-phenylacrylonitrile,beta-cyanostyrene,cinnamonitrile, e,3-phenyl-2-propenenitrile,acrylonitrile, 3-phenyl,e-3-phenylprop-2-enenitrile PubChem CID: 1550846 IUPAC Name: (E)-3-phenylprop-2-enenitrile SMILES: C1=CC=C(C=C1)C=CC#N
| PubChem CID | 1550846 |
|---|---|
| CAS | 1885-38-7 |
| Molecular Weight (g/mol) | 129.162 |
| MDL Number | MFCD00001930 |
| SMILES | C1=CC=C(C=C1)C=CC#N |
| Synonym | cinnamonitrile,trans-cinnamonitrile,styryl cyanide,cinnamyl nitrile,3-phenylacrylonitrile,beta-cyanostyrene,cinnamonitrile, e,3-phenyl-2-propenenitrile,acrylonitrile, 3-phenyl,e-3-phenylprop-2-enenitrile |
| IUPAC Name | (E)-3-phenylprop-2-enenitrile |
| InChI Key | ZWKNLRXFUTWSOY-QPJJXVBHSA-N |
| Molecular Formula | C9H7N |
alpha'-Bromo-alpha,alpha,alpha-trifluoro-p-xylene, 98%
CAS: 402-49-3 Molecular Formula: C8H6BrF3 Molecular Weight (g/mol): 239.04 MDL Number: MFCD00000403 InChI Key: IKSNDOVDVVPSMA-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzyl bromide,1-bromomethyl-4-trifluoromethyl benzene,4-trifluoromethylbenzyl bromide,4-bromomethyl benzotrifluoride,p-trifluoromethylbenzyl bromide,4-trifluoromethyl benzylbromide,benzene, 1-bromomethyl-4-trifluoromethyl,4-trifluoromethylbenzylbromide,p-trifluoromethyl benzyl bromide,alpha'-bromo-alpha,alpha,alpha-trifluoro-p-xylene PubChem CID: 123062 IUPAC Name: 1-(bromomethyl)-4-(trifluoromethyl)benzene SMILES: C1=CC(=CC=C1CBr)C(F)(F)F
| PubChem CID | 123062 |
|---|---|
| CAS | 402-49-3 |
| Molecular Weight (g/mol) | 239.04 |
| MDL Number | MFCD00000403 |
| SMILES | C1=CC(=CC=C1CBr)C(F)(F)F |
| Synonym | 4-trifluoromethyl benzyl bromide,1-bromomethyl-4-trifluoromethyl benzene,4-trifluoromethylbenzyl bromide,4-bromomethyl benzotrifluoride,p-trifluoromethylbenzyl bromide,4-trifluoromethyl benzylbromide,benzene, 1-bromomethyl-4-trifluoromethyl,4-trifluoromethylbenzylbromide,p-trifluoromethyl benzyl bromide,alpha'-bromo-alpha,alpha,alpha-trifluoro-p-xylene |
| IUPAC Name | 1-(bromomethyl)-4-(trifluoromethyl)benzene |
| InChI Key | IKSNDOVDVVPSMA-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrF3 |
3-Iodobenzoic acid, 98%
CAS: 618-51-9 Molecular Formula: C7H5IO2 Molecular Weight (g/mol): 248.01 MDL Number: MFCD00002496 InChI Key: KVBWBCRPWVKFQT-UHFFFAOYSA-N Synonym: m-iodobenzoic acid,benzoic acid, 3-iodo,3-iodo-benzoic acid,benzoic acid, m-iodo,3-iodobenzoicacid,3-carboxyiodobenzene,3-iodo benzoic acid,pubchem3925,acmc-209mwv,meta-carboxy iodo-benzene PubChem CID: 12060 IUPAC Name: 3-iodobenzoic acid SMILES: C1=CC(=CC(=C1)I)C(=O)O
| PubChem CID | 12060 |
|---|---|
| CAS | 618-51-9 |
| Molecular Weight (g/mol) | 248.01 |
| MDL Number | MFCD00002496 |
| SMILES | C1=CC(=CC(=C1)I)C(=O)O |
| Synonym | m-iodobenzoic acid,benzoic acid, 3-iodo,3-iodo-benzoic acid,benzoic acid, m-iodo,3-iodobenzoicacid,3-carboxyiodobenzene,3-iodo benzoic acid,pubchem3925,acmc-209mwv,meta-carboxy iodo-benzene |
| IUPAC Name | 3-iodobenzoic acid |
| InChI Key | KVBWBCRPWVKFQT-UHFFFAOYSA-N |
| Molecular Formula | C7H5IO2 |
N-Isopropylbenzylamine, 97%
CAS: 102-97-6 Molecular Formula: C10H15N Molecular Weight (g/mol): 149.237 MDL Number: MFCD00008863 InChI Key: LYBKPDDZTNUNNM-UHFFFAOYSA-N Synonym: n-isopropylbenzylamine,n-benzylisopropylamine,isopropylbenzylamine,n-benzyl-n-isopropylamine,benzylisopropylamine,benzenemethanamine, n-1-methylethyl,n-benzyl isopropylamine,benzylamine, n-isopropyl,n-1-methylethyl-benzenemethanamine,benzyl propan-2-yl amine PubChem CID: 66024 IUPAC Name: N-benzylpropan-2-amine SMILES: CC(C)NCC1=CC=CC=C1
| PubChem CID | 66024 |
|---|---|
| CAS | 102-97-6 |
| Molecular Weight (g/mol) | 149.237 |
| MDL Number | MFCD00008863 |
| SMILES | CC(C)NCC1=CC=CC=C1 |
| Synonym | n-isopropylbenzylamine,n-benzylisopropylamine,isopropylbenzylamine,n-benzyl-n-isopropylamine,benzylisopropylamine,benzenemethanamine, n-1-methylethyl,n-benzyl isopropylamine,benzylamine, n-isopropyl,n-1-methylethyl-benzenemethanamine,benzyl propan-2-yl amine |
| IUPAC Name | N-benzylpropan-2-amine |
| InChI Key | LYBKPDDZTNUNNM-UHFFFAOYSA-N |
| Molecular Formula | C10H15N |
Sulfanilic Acid, Anhydrous, ACS, 98-102%, Spectrum™ Chemical
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CAS: 121-57-3 Molecular Formula: C6H7NO3S Molecular Weight (g/mol): 173.19 InChI Key: HVBSAKJJOYLTQU-UHFFFAOYSA-N IUPAC Name: 4-aminobenzene-1-sulfonic acid SMILES: NC1=CC=C(C=C1)S(O)(=O)=O
| CAS | 121-57-3 |
|---|---|
| Molecular Weight (g/mol) | 173.19 |
| SMILES | NC1=CC=C(C=C1)S(O)(=O)=O |
| IUPAC Name | 4-aminobenzene-1-sulfonic acid |
| InChI Key | HVBSAKJJOYLTQU-UHFFFAOYSA-N |
| Molecular Formula | C6H7NO3S |