Benzene and substituted derivatives
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4-Amino-2,3,5,6-tetrafluorobenzoic Acid 97.0+%, TCI America™
CAS: 944-43-4 Molecular Formula: C7H3F4NO2 Molecular Weight (g/mol): 209.1 MDL Number: MFCD00007647 InChI Key: WTNSXWSOTDBWOR-UHFFFAOYSA-N Synonym: 2,3,5,6-tetrafluoro-4-aminobenzoic acid,acmc-209rrw,4-amino-2,3,5,6-tetrafluorobenzoicacid,2,3,5,6-tetrafluoro-4-amino-benzoic acid,4-amino-2,3,5,6-tetrafluoro-benzoic acid,benzoic acid,4-amino-2,3,5,6-tetrafluoro,benzoic acid, 4-amino-2,3,5,6-tetrafluoro,4-amino-2,3,5,6-tetrafluorobenzoic acid PubChem CID: 70345 IUPAC Name: 4-amino-2,3,5,6-tetrafluorobenzoic acid SMILES: C1(=C(C(=C(C(=C1F)F)N)F)F)C(=O)O
| PubChem CID | 70345 |
|---|---|
| CAS | 944-43-4 |
| Molecular Weight (g/mol) | 209.1 |
| MDL Number | MFCD00007647 |
| SMILES | C1(=C(C(=C(C(=C1F)F)N)F)F)C(=O)O |
| Synonym | 2,3,5,6-tetrafluoro-4-aminobenzoic acid,acmc-209rrw,4-amino-2,3,5,6-tetrafluorobenzoicacid,2,3,5,6-tetrafluoro-4-amino-benzoic acid,4-amino-2,3,5,6-tetrafluoro-benzoic acid,benzoic acid,4-amino-2,3,5,6-tetrafluoro,benzoic acid, 4-amino-2,3,5,6-tetrafluoro,4-amino-2,3,5,6-tetrafluorobenzoic acid |
| IUPAC Name | 4-amino-2,3,5,6-tetrafluorobenzoic acid |
| InChI Key | WTNSXWSOTDBWOR-UHFFFAOYSA-N |
| Molecular Formula | C7H3F4NO2 |
Methyl m-Anisate 98.0+%, TCI America™
CAS: 5368-81-0 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00017193 InChI Key: DUKYPQBGYRJVAN-UHFFFAOYSA-N Synonym: methyl m-anisate,methyl m-methoxybenzoate,3-methoxybenzoic acid methyl ester,m-anisic acid, methyl ester,benzoic acid, 3-methoxy-, methyl ester,3-methoxybenoic acid methyl ester,m-methoxybenzoic acid methyl ester,mehtyl 3-methoxybenzoate,acmc-1asq5,m-anisic acid methyl ester PubChem CID: 79332 IUPAC Name: methyl 3-methoxybenzoate SMILES: COC(=O)C1=CC=CC(OC)=C1
| PubChem CID | 79332 |
|---|---|
| CAS | 5368-81-0 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00017193 |
| SMILES | COC(=O)C1=CC=CC(OC)=C1 |
| Synonym | methyl m-anisate,methyl m-methoxybenzoate,3-methoxybenzoic acid methyl ester,m-anisic acid, methyl ester,benzoic acid, 3-methoxy-, methyl ester,3-methoxybenoic acid methyl ester,m-methoxybenzoic acid methyl ester,mehtyl 3-methoxybenzoate,acmc-1asq5,m-anisic acid methyl ester |
| IUPAC Name | methyl 3-methoxybenzoate |
| InChI Key | DUKYPQBGYRJVAN-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
p-Anisidine-2-sulfonic Acid 97.0+%, TCI America™
CAS: 13244-33-2 Molecular Formula: C7H9NO4S Molecular Weight (g/mol): 203.212 MDL Number: MFCD00035804 InChI Key: KZKGEEGADAWJFS-UHFFFAOYSA-N Synonym: 4-aminoanisole-3-sulfonic acid,p-anisidine-3-sulfonic acid,benzenesulfonic acid, 2-amino-5-methoxy,4-methoxy-2-sulfoaniline,2-amino-5-methoxybenzenesulphonic acid,unii-hju535j932,2-amino-5-methoxybenzene-1-sulfonic acid,4-methoxyaniline-2-sulfonic acid,4-anisidine-2-sulfonicacid,2-amino-5-methoxy benzenesulfonic acid PubChem CID: 83260 IUPAC Name: 2-amino-5-methoxybenzenesulfonic acid SMILES: COC1=CC(=C(C=C1)N)S(=O)(=O)O
| PubChem CID | 83260 |
|---|---|
| CAS | 13244-33-2 |
| Molecular Weight (g/mol) | 203.212 |
| MDL Number | MFCD00035804 |
| SMILES | COC1=CC(=C(C=C1)N)S(=O)(=O)O |
| Synonym | 4-aminoanisole-3-sulfonic acid,p-anisidine-3-sulfonic acid,benzenesulfonic acid, 2-amino-5-methoxy,4-methoxy-2-sulfoaniline,2-amino-5-methoxybenzenesulphonic acid,unii-hju535j932,2-amino-5-methoxybenzene-1-sulfonic acid,4-methoxyaniline-2-sulfonic acid,4-anisidine-2-sulfonicacid,2-amino-5-methoxy benzenesulfonic acid |
| IUPAC Name | 2-amino-5-methoxybenzenesulfonic acid |
| InChI Key | KZKGEEGADAWJFS-UHFFFAOYSA-N |
| Molecular Formula | C7H9NO4S |
2-Amino-3-bromo-5-nitrobenzonitrile 98.0+%, TCI America™
CAS: 17601-94-4 Molecular Formula: C7H4BrN3O2 Molecular Weight (g/mol): 242.032 MDL Number: MFCD00054185 InChI Key: MUHLVSZIVTURCZ-UHFFFAOYSA-N Synonym: benzonitrile, 2-amino-3-bromo-5-nitro,6-bromo-2-cyano-4-nitroaniline,2-bromo-6-cyano-4-nitroaniline,2-cyano-4-nitro-6-bromoaniline,2-amino-3-bromo-5-nitrobenzenecarbonitrile,pubchem2331,2-amino-3-bromo-1-cyano-5-nitrobenzene,acmc-1bus8,cambridge id 5228140,ksc496g6h PubChem CID: 87173 IUPAC Name: 2-amino-3-bromo-5-nitrobenzonitrile SMILES: C1=C(C=C(C(=C1Br)N)C#N)[N+](=O)[O-]
| PubChem CID | 87173 |
|---|---|
| CAS | 17601-94-4 |
| Molecular Weight (g/mol) | 242.032 |
| MDL Number | MFCD00054185 |
| SMILES | C1=C(C=C(C(=C1Br)N)C#N)[N+](=O)[O-] |
| Synonym | benzonitrile, 2-amino-3-bromo-5-nitro,6-bromo-2-cyano-4-nitroaniline,2-bromo-6-cyano-4-nitroaniline,2-cyano-4-nitro-6-bromoaniline,2-amino-3-bromo-5-nitrobenzenecarbonitrile,pubchem2331,2-amino-3-bromo-1-cyano-5-nitrobenzene,acmc-1bus8,cambridge id 5228140,ksc496g6h |
| IUPAC Name | 2-amino-3-bromo-5-nitrobenzonitrile |
| InChI Key | MUHLVSZIVTURCZ-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrN3O2 |
Anastrozole 98.0+%, TCI America™
CAS: 120511-73-1 Molecular Formula: C17H19N5 Molecular Weight (g/mol): 293.374 MDL Number: MFCD00866298 InChI Key: YBBLVLTVTVSKRW-UHFFFAOYSA-N Synonym: anastrozole,arimidex,anastrazole,anastrozol,2,2'-5-1h-1,2,4-triazol-1-yl methyl-1,3-phenylene bis 2-methylpropanenitrile,anastrole,asiolex,zeneca zd 1033,unii-2z07myw1az,arimidex tn PubChem CID: 2187 ChEBI: CHEBI:2704 IUPAC Name: 2-[3-(2-cyanopropan-2-yl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]-2-methylpropanenitrile SMILES: CC(C)(C#N)C1=CC(=CC(=C1)CN2C=NC=N2)C(C)(C)C#N
| PubChem CID | 2187 |
|---|---|
| CAS | 120511-73-1 |
| Molecular Weight (g/mol) | 293.374 |
| ChEBI | CHEBI:2704 |
| MDL Number | MFCD00866298 |
| SMILES | CC(C)(C#N)C1=CC(=CC(=C1)CN2C=NC=N2)C(C)(C)C#N |
| Synonym | anastrozole,arimidex,anastrazole,anastrozol,2,2'-5-1h-1,2,4-triazol-1-yl methyl-1,3-phenylene bis 2-methylpropanenitrile,anastrole,asiolex,zeneca zd 1033,unii-2z07myw1az,arimidex tn |
| IUPAC Name | 2-[3-(2-cyanopropan-2-yl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]-2-methylpropanenitrile |
| InChI Key | YBBLVLTVTVSKRW-UHFFFAOYSA-N |
| Molecular Formula | C17H19N5 |
1-(3-Acetamidophenyl)-5-mercaptotetrazole 98.0+%, TCI America™
CAS: 14070-48-5 Molecular Formula: C9H9N5OS Molecular Weight (g/mol): 235.27 MDL Number: MFCD00603728 InChI Key: SCWKACOBHZIKDI-UHFFFAOYSA-N PubChem CID: 712430 IUPAC Name: N-[3-(5-sulfanylidene-2,5-dihydro-1H-1,2,3,4-tetrazol-1-yl)phenyl]acetamide SMILES: CC(=O)NC1=CC=CC(=C1)N1NN=NC1=S
| PubChem CID | 712430 |
|---|---|
| CAS | 14070-48-5 |
| Molecular Weight (g/mol) | 235.27 |
| MDL Number | MFCD00603728 |
| SMILES | CC(=O)NC1=CC=CC(=C1)N1NN=NC1=S |
| IUPAC Name | N-[3-(5-sulfanylidene-2,5-dihydro-1H-1,2,3,4-tetrazol-1-yl)phenyl]acetamide |
| InChI Key | SCWKACOBHZIKDI-UHFFFAOYSA-N |
| Molecular Formula | C9H9N5OS |
3'-Aminoacetanilide 98.0+%, TCI America™
CAS: 102-28-3 Molecular Formula: C8H10N2O Molecular Weight (g/mol): 150.18 MDL Number: MFCD00025229 InChI Key: PEMGGJDINLGTON-UHFFFAOYSA-N Synonym: n-3-aminophenyl acetamide,3'-aminoacetanilide,3-aminoacetanilide,m-aminoacetanilide,acetamide, n-3-aminophenyl,3-acetamidoaniline,m-acetaminoaniline,m-acetylamino aniline,3-aminoacetanilid,3-amino-n-acetylaniline PubChem CID: 7604 IUPAC Name: N-(3-aminophenyl)acetamide SMILES: CC(=O)NC1=CC=CC(N)=C1
| PubChem CID | 7604 |
|---|---|
| CAS | 102-28-3 |
| Molecular Weight (g/mol) | 150.18 |
| MDL Number | MFCD00025229 |
| SMILES | CC(=O)NC1=CC=CC(N)=C1 |
| Synonym | n-3-aminophenyl acetamide,3'-aminoacetanilide,3-aminoacetanilide,m-aminoacetanilide,acetamide, n-3-aminophenyl,3-acetamidoaniline,m-acetaminoaniline,m-acetylamino aniline,3-aminoacetanilid,3-amino-n-acetylaniline |
| IUPAC Name | N-(3-aminophenyl)acetamide |
| InChI Key | PEMGGJDINLGTON-UHFFFAOYSA-N |
| Molecular Formula | C8H10N2O |
3-Bromo-5-nitrobenzotrifluoride 98.0+%, TCI America™
CAS: 630125-49-4 Molecular Formula: C7H3BrF3NO2 Molecular Weight (g/mol): 270.01 MDL Number: MFCD03788719 InChI Key: YHTVYRKVFAFVLP-UHFFFAOYSA-N Synonym: 3-bromo-5-nitrobenzotrifluoride,1-bromo-3-nitro-5-trifluoromethyl benzene,3-bromo-5-trifluoromethylnitrobenzene,3-nitro-5-bromobenzotrifluoride,benzene, 1-bromo-3-nitro-5-trifluoromethyl,5-bromo-3-trifluoromethyl nitrobenzene,1-bromo-3-nitro-5-trifluoromethyl-benzene,3-bromo-5-nitrotrifluorotoluene,3-bromo-1-nitro-5-trifluoromethyl benzene,zlchem 416 PubChem CID: 7015411 IUPAC Name: 1-bromo-3-nitro-5-(trifluoromethyl)benzene SMILES: [O-][N+](=O)C1=CC(Br)=CC(=C1)C(F)(F)F
| PubChem CID | 7015411 |
|---|---|
| CAS | 630125-49-4 |
| Molecular Weight (g/mol) | 270.01 |
| MDL Number | MFCD03788719 |
| SMILES | [O-][N+](=O)C1=CC(Br)=CC(=C1)C(F)(F)F |
| Synonym | 3-bromo-5-nitrobenzotrifluoride,1-bromo-3-nitro-5-trifluoromethyl benzene,3-bromo-5-trifluoromethylnitrobenzene,3-nitro-5-bromobenzotrifluoride,benzene, 1-bromo-3-nitro-5-trifluoromethyl,5-bromo-3-trifluoromethyl nitrobenzene,1-bromo-3-nitro-5-trifluoromethyl-benzene,3-bromo-5-nitrotrifluorotoluene,3-bromo-1-nitro-5-trifluoromethyl benzene,zlchem 416 |
| IUPAC Name | 1-bromo-3-nitro-5-(trifluoromethyl)benzene |
| InChI Key | YHTVYRKVFAFVLP-UHFFFAOYSA-N |
| Molecular Formula | C7H3BrF3NO2 |
2-Amino-2',4-dichlorodiphenyl Ether 98.0+%, TCI America™
CAS: 56966-48-4 Molecular Formula: C12H9Cl2NO Molecular Weight (g/mol): 254.11 MDL Number: MFCD00025218 InChI Key: PHORTNLNXNZNET-UHFFFAOYSA-N Synonym: 5-Chloro-2-(2-chlorophenoxy)aniline PubChem CID: 92601 IUPAC Name: 5-chloro-2-(2-chlorophenoxy)aniline SMILES: C1=CC=C(C(=C1)OC2=C(C=C(C=C2)Cl)N)Cl
| PubChem CID | 92601 |
|---|---|
| CAS | 56966-48-4 |
| Molecular Weight (g/mol) | 254.11 |
| MDL Number | MFCD00025218 |
| SMILES | C1=CC=C(C(=C1)OC2=C(C=C(C=C2)Cl)N)Cl |
| Synonym | 5-Chloro-2-(2-chlorophenoxy)aniline |
| IUPAC Name | 5-chloro-2-(2-chlorophenoxy)aniline |
| InChI Key | PHORTNLNXNZNET-UHFFFAOYSA-N |
| Molecular Formula | C12H9Cl2NO |
4-Aminobenzophenone 98.0+%, TCI America™
CAS: 1137-41-3 Molecular Formula: C13H11NO Molecular Weight (g/mol): 197.24 MDL Number: MFCD00007895 InChI Key: RBKHNGHPZZZJCI-UHFFFAOYSA-N Synonym: 4-aminobenzophenone,4-aminophenyl phenyl methanone,4-benzoylaniline,p-aminobenzophenone,methanone, 4-aminophenyl phenyl,benzophenone, 4-amino,p-benzoylaniline,usaf a-233,4-aminophenyl-phenylmethanone,4-aminophenyl-phenyl-methanone PubChem CID: 14346 IUPAC Name: 4-benzoylaniline SMILES: NC1=CC=C(C=C1)C(=O)C1=CC=CC=C1
| PubChem CID | 14346 |
|---|---|
| CAS | 1137-41-3 |
| Molecular Weight (g/mol) | 197.24 |
| MDL Number | MFCD00007895 |
| SMILES | NC1=CC=C(C=C1)C(=O)C1=CC=CC=C1 |
| Synonym | 4-aminobenzophenone,4-aminophenyl phenyl methanone,4-benzoylaniline,p-aminobenzophenone,methanone, 4-aminophenyl phenyl,benzophenone, 4-amino,p-benzoylaniline,usaf a-233,4-aminophenyl-phenylmethanone,4-aminophenyl-phenyl-methanone |
| IUPAC Name | 4-benzoylaniline |
| InChI Key | RBKHNGHPZZZJCI-UHFFFAOYSA-N |
| Molecular Formula | C13H11NO |
2-Amino-5-fluorobenzotrifluoride 97.0+%, TCI America™
CAS: 393-39-5 Molecular Formula: C7H5F4N Molecular Weight (g/mol): 179.12 MDL Number: MFCD00007831 InChI Key: LRCQLCWUUBSUOY-UHFFFAOYSA-N Synonym: 2-amino-5-fluorobenzotrifluoride,4-fluoro-2-trifluoromethyl aniline,4-fluoro-2-trifluoromethyl-phenylamine,benzenamine, 4-fluoro-2-trifluoromethyl,alpha,alpha,alpha,4-tetrafluoro-o-toluidine,alpha,2-amino-5-fluoro benzotrifluoride,4-fluoro-2-trifluoromethyl phenylamine,alpha,alpha,alpha-4-tetrafluoro-o-toluidine,benzenamine,4-fluoro-2-trifluoromethyl PubChem CID: 67853 IUPAC Name: 4-fluoro-2-(trifluoromethyl)aniline SMILES: NC1=CC=C(F)C=C1C(F)(F)F
| PubChem CID | 67853 |
|---|---|
| CAS | 393-39-5 |
| Molecular Weight (g/mol) | 179.12 |
| MDL Number | MFCD00007831 |
| SMILES | NC1=CC=C(F)C=C1C(F)(F)F |
| Synonym | 2-amino-5-fluorobenzotrifluoride,4-fluoro-2-trifluoromethyl aniline,4-fluoro-2-trifluoromethyl-phenylamine,benzenamine, 4-fluoro-2-trifluoromethyl,alpha,alpha,alpha,4-tetrafluoro-o-toluidine,alpha,2-amino-5-fluoro benzotrifluoride,4-fluoro-2-trifluoromethyl phenylamine,alpha,alpha,alpha-4-tetrafluoro-o-toluidine,benzenamine,4-fluoro-2-trifluoromethyl |
| IUPAC Name | 4-fluoro-2-(trifluoromethyl)aniline |
| InChI Key | LRCQLCWUUBSUOY-UHFFFAOYSA-N |
| Molecular Formula | C7H5F4N |
2-Amino-5-chloro-2'-fluorobenzophenone 98.0+%, TCI America™
CAS: 784-38-3 Molecular Formula: C13H9ClFNO Molecular Weight (g/mol): 249.669 MDL Number: MFCD00038381 InChI Key: GTGMXPIQRQSORU-UHFFFAOYSA-N Synonym: 2-amino-5-chloro-2'-fluorobenzophenone,2-amino-5-chlorophenyl 2-fluorophenyl methanone,2-amino-2'-fluoro-5-chlorobenzophenone,methanone, 2-amino-5-chlorophenyl 2-fluorophenyl,4-chloro-2-2-fluorobenzoyl aniline,2-amino-5-chloro-phenyl-2-fluorophenyl methanone,2-amino-5-chlorophenyl 2-fluorophenyl ketone,2-amino-5-chlorophenyl-2-fluorophenyl methanone,pubchem3252,acmc-1bd5r PubChem CID: 69912 IUPAC Name: (2-amino-5-chlorophenyl)-(2-fluorophenyl)methanone SMILES: C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Cl)N)F
| PubChem CID | 69912 |
|---|---|
| CAS | 784-38-3 |
| Molecular Weight (g/mol) | 249.669 |
| MDL Number | MFCD00038381 |
| SMILES | C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Cl)N)F |
| Synonym | 2-amino-5-chloro-2'-fluorobenzophenone,2-amino-5-chlorophenyl 2-fluorophenyl methanone,2-amino-2'-fluoro-5-chlorobenzophenone,methanone, 2-amino-5-chlorophenyl 2-fluorophenyl,4-chloro-2-2-fluorobenzoyl aniline,2-amino-5-chloro-phenyl-2-fluorophenyl methanone,2-amino-5-chlorophenyl 2-fluorophenyl ketone,2-amino-5-chlorophenyl-2-fluorophenyl methanone,pubchem3252,acmc-1bd5r |
| IUPAC Name | (2-amino-5-chlorophenyl)-(2-fluorophenyl)methanone |
| InChI Key | GTGMXPIQRQSORU-UHFFFAOYSA-N |
| Molecular Formula | C13H9ClFNO |
1-Methyl 2-Aminoterephthalate 98.0+%, TCI America™
CAS: 60728-41-8 Molecular Formula: C9H9NO4 Molecular Weight (g/mol): 195.174 MDL Number: MFCD00189374 InChI Key: QKOKLMFCKLEFDV-UHFFFAOYSA-N Synonym: 3-Amino-4-carbomethoxybenzoic Acid, 3-Amino-4-methoxycarbonylbenzoic Acid, 2-Aminoterephthalic Acid 1-Methyl Ester PubChem CID: 5235500 IUPAC Name: 3-amino-4-methoxycarbonylbenzoic acid SMILES: COC(=O)C1=C(C=C(C=C1)C(=O)O)N
| PubChem CID | 5235500 |
|---|---|
| CAS | 60728-41-8 |
| Molecular Weight (g/mol) | 195.174 |
| MDL Number | MFCD00189374 |
| SMILES | COC(=O)C1=C(C=C(C=C1)C(=O)O)N |
| Synonym | 3-Amino-4-carbomethoxybenzoic Acid, 3-Amino-4-methoxycarbonylbenzoic Acid, 2-Aminoterephthalic Acid 1-Methyl Ester |
| IUPAC Name | 3-amino-4-methoxycarbonylbenzoic acid |
| InChI Key | QKOKLMFCKLEFDV-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO4 |
Allylpentafluorobenzene 98.0+%, TCI America™
CAS: 1736-60-3 Molecular Formula: C9H5F5 Molecular Weight (g/mol): 208.13 MDL Number: MFCD00000301 InChI Key: YBDBTBVNQQBHGJ-UHFFFAOYSA-N Synonym: allylpentafluorobenzene,benzene, allylpentafluoro,3-pentafluorophenyl-1-propene,2,3,4,5,6-pentafluoro allylbenzene,benzene, pentafluoro-2-propenyl,1,2,3,4,5-pentafluoro-6-prop-2-en-1-yl benzene,allyl pentafluorobenzene,pubchem13366,acmc-1bth5 PubChem CID: 74435 IUPAC Name: 1,2,3,4,5-pentafluoro-6-(prop-2-en-1-yl)benzene SMILES: FC1=C(F)C(F)=C(CC=C)C(F)=C1F
| PubChem CID | 74435 |
|---|---|
| CAS | 1736-60-3 |
| Molecular Weight (g/mol) | 208.13 |
| MDL Number | MFCD00000301 |
| SMILES | FC1=C(F)C(F)=C(CC=C)C(F)=C1F |
| Synonym | allylpentafluorobenzene,benzene, allylpentafluoro,3-pentafluorophenyl-1-propene,2,3,4,5,6-pentafluoro allylbenzene,benzene, pentafluoro-2-propenyl,1,2,3,4,5-pentafluoro-6-prop-2-en-1-yl benzene,allyl pentafluorobenzene,pubchem13366,acmc-1bth5 |
| IUPAC Name | 1,2,3,4,5-pentafluoro-6-(prop-2-en-1-yl)benzene |
| InChI Key | YBDBTBVNQQBHGJ-UHFFFAOYSA-N |
| Molecular Formula | C9H5F5 |
(4-Allyl-2-methoxyphenoxy)acetic Acid 98.0+%, TCI America™
CAS: 6331-61-9 Molecular Formula: C12H14O4 Molecular Weight (g/mol): 222.24 MDL Number: MFCD00017594 InChI Key: FQBPCNCFOCPCJP-UHFFFAOYSA-N PubChem CID: 235909 IUPAC Name: 2-(2-methoxy-4-prop-2-enylphenoxy)acetic acid SMILES: COC1=C(C=CC(=C1)CC=C)OCC(=O)O
| PubChem CID | 235909 |
|---|---|
| CAS | 6331-61-9 |
| Molecular Weight (g/mol) | 222.24 |
| MDL Number | MFCD00017594 |
| SMILES | COC1=C(C=CC(=C1)CC=C)OCC(=O)O |
| IUPAC Name | 2-(2-methoxy-4-prop-2-enylphenoxy)acetic acid |
| InChI Key | FQBPCNCFOCPCJP-UHFFFAOYSA-N |
| Molecular Formula | C12H14O4 |