Benzenediols
- (50)
- (5)
- (5)
- (4)
- (37)
- (1)
- (9)
- (4)
- (1)
- (1)
- (3)
- (4)
- (85)
- (1)
- (2)
- (11)
- (10)
- (1)
- (74)
- (3)
- (1)
- (7)
- (1)
- (34)
- (3)
- (3)
- (19)
- (15)
- (10)
- (26)
- (5)
- (6)
- (2)
- (3)
- (5)
- (12)
- (13)
- (4)
- (2)
- (5)
- (7)
- (1)
- (2)
- (2)
- (4)
- (1)
- (10)
- (16)
- (2)
- (14)
- (1)
- (1)
- (3)
- (5)
- (4)
- (9)
- (2)
- (1)
- (2)
- (1)
- (1)
- (4)
- (2)
- (2)
- (6)
- (3)
- (1)
- (4)
- (2)
- (12)
- (2)
- (4)
- (2)
- (6)
- (2)
- (3)
- (7)
- (2)
- (6)
- (4)
- (1)
- (4)
- (1)
- (4)
- (4)
- (2)
- (5)
- (3)
- (5)
- (1)
- (3)
- (2)
- (4)
- (6)
- (2)
- (3)
- (1)
- (4)
- (2)
- (1)
- (2)
- (1)
- (1)
- (3)
- (6)
- (2)
- (3)
- (1)
- (2)
- (5)
- (12)
- (44)
- (23)
- (7)
- (2)
- (11)
- (2)
- (15)
- (2)
- (10)
- (2)
- (6)
- (1)
- (5)
- (7)
- (5)
- (6)
- (43)
- (72)
- (2)
- (34)
- (6)
- (3)
- (5)
- (5)
- (3)
- (4)
- (171)
- (3)
- (14)
- (1)
- (3)
- (2)
- (2)
- (6)
- (2)
- (7)
- (5)
- (23)
- (2)
- (6)
- (1)
- (3)
- (2)
- (2)
- (2)
- (2)
- (2)
- (2)
- (3)
- (2)
- (2)
- (3)
- (2)
- (2)
- (2)
- (2)
- (2)
- (1)
- (3)
- (2)
- (3)
- (1)
- (1)
- (2)
- (2)
- (2)
- (4)
- (4)
- (6)
- (2)
- (5)
- (3)
- (7)
- (4)
- (2)
- (2)
- (3)
- (5)
- (2)
- (5)
- (2)
- (3)
- (2)
Filtered Search Results
3,4-Dihydroxybenzoic acid, 97%
CAS: 99-50-3 Molecular Formula: C7H6O4 Molecular Weight (g/mol): 154.121 MDL Number: MFCD00002509 InChI Key: YQUVCSBJEUQKSH-UHFFFAOYSA-N Synonym: protocatechuic acid,4-carboxy-1,2-dihydroxybenzene,protocatehuic acid,benzoic acid, 3,4-dihydroxy,protocatechuate,4,5-dihydroxybenzoic acid,3,4-dihydroxybenzoicacid,unii-36r5qj8l4b,ccris 6291,chembl37537 PubChem CID: 72 ChEBI: CHEBI:36062 IUPAC Name: 3,4-dihydroxybenzoic acid SMILES: C1=CC(=C(C=C1C(=O)O)O)O
| PubChem CID | 72 |
|---|---|
| CAS | 99-50-3 |
| Molecular Weight (g/mol) | 154.121 |
| ChEBI | CHEBI:36062 |
| MDL Number | MFCD00002509 |
| SMILES | C1=CC(=C(C=C1C(=O)O)O)O |
| Synonym | protocatechuic acid,4-carboxy-1,2-dihydroxybenzene,protocatehuic acid,benzoic acid, 3,4-dihydroxy,protocatechuate,4,5-dihydroxybenzoic acid,3,4-dihydroxybenzoicacid,unii-36r5qj8l4b,ccris 6291,chembl37537 |
| IUPAC Name | 3,4-dihydroxybenzoic acid |
| InChI Key | YQUVCSBJEUQKSH-UHFFFAOYSA-N |
| Molecular Formula | C7H6O4 |
2,3-Dicyanohydroquinone, 98%
CAS: 4733-50-0 MDL Number: MFCD00001790 InChI Key: MPAIWVOBMLSHQA-UHFFFAOYSA-N Synonym: 2,3-dicyanohydroquinone,3,6-dihydroxyphthalonitrile,2,3-dicyano-p-hydroquinone,3,6-dihydroxyphthalodinitrile,1,2-benzenedicarbonitrile, 3,6-dihydroxy,2,3-dicyanobenzene-1,4-diol,phthalonitrile, 3,6-dihydroxy,dicyanohydroquinone,2,3-dicyanohydroquinme,acmc-1asrw PubChem CID: 78467 IUPAC Name: 3,6-dihydroxybenzene-1,2-dicarbonitrile SMILES: C1=CC(=C(C(=C1O)C#N)C#N)O
| PubChem CID | 78467 |
|---|---|
| CAS | 4733-50-0 |
| MDL Number | MFCD00001790 |
| SMILES | C1=CC(=C(C(=C1O)C#N)C#N)O |
| Synonym | 2,3-dicyanohydroquinone,3,6-dihydroxyphthalonitrile,2,3-dicyano-p-hydroquinone,3,6-dihydroxyphthalodinitrile,1,2-benzenedicarbonitrile, 3,6-dihydroxy,2,3-dicyanobenzene-1,4-diol,phthalonitrile, 3,6-dihydroxy,dicyanohydroquinone,2,3-dicyanohydroquinme,acmc-1asrw |
| IUPAC Name | 3,6-dihydroxybenzene-1,2-dicarbonitrile |
| InChI Key | MPAIWVOBMLSHQA-UHFFFAOYSA-N |
Methyl caffeate
CAS: 3843-74-1 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.186 MDL Number: MFCD00210468 InChI Key: OCNYGKNIVPVPPX-HWKANZROSA-N Synonym: methyl caffeate,methyl 3-3,4-dihydroxyphenyl acrylate,caffeic acid methyl ester,e-methyl 3-3,4-dihydroxyphenyl acrylate,methylcaffeate,methyl 3,4-dihydroxycinnamate,caffeic acid, methyl ester,unii-n79173b9hf,methyl 2e-3-3,4-dihydroxyphenyl prop-2-enoate,chembl17001 PubChem CID: 689075 ChEBI: CHEBI:6856 IUPAC Name: methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate SMILES: COC(=O)C=CC1=CC(=C(C=C1)O)O
| PubChem CID | 689075 |
|---|---|
| CAS | 3843-74-1 |
| Molecular Weight (g/mol) | 194.186 |
| ChEBI | CHEBI:6856 |
| MDL Number | MFCD00210468 |
| SMILES | COC(=O)C=CC1=CC(=C(C=C1)O)O |
| Synonym | methyl caffeate,methyl 3-3,4-dihydroxyphenyl acrylate,caffeic acid methyl ester,e-methyl 3-3,4-dihydroxyphenyl acrylate,methylcaffeate,methyl 3,4-dihydroxycinnamate,caffeic acid, methyl ester,unii-n79173b9hf,methyl 2e-3-3,4-dihydroxyphenyl prop-2-enoate,chembl17001 |
| IUPAC Name | methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate |
| InChI Key | OCNYGKNIVPVPPX-HWKANZROSA-N |
| Molecular Formula | C10H10O4 |
4-Ethylresorcinol, 98%
CAS: 2896-60-8 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00002283 InChI Key: VGMJYYDKPUPTID-UHFFFAOYSA-N Synonym: 4-ethylresorcinol,1,3-benzenediol, 4-ethyl,6-ethylresorcinol,resorcinol, 4-ethyl,1,3-dihydroxy-4-ethylbenzene,4-ethyl resorcinol,2,4-dihydroxy-1-ethylbenzene,unii-8ye81t06d5,4-ethyl-benzene-1,3-diol,4-ethyl-resorcinol PubChem CID: 17927 IUPAC Name: 4-ethylbenzene-1,3-diol SMILES: CCC1=C(C=C(C=C1)O)O
| PubChem CID | 17927 |
|---|---|
| CAS | 2896-60-8 |
| Molecular Weight (g/mol) | 138.166 |
| MDL Number | MFCD00002283 |
| SMILES | CCC1=C(C=C(C=C1)O)O |
| Synonym | 4-ethylresorcinol,1,3-benzenediol, 4-ethyl,6-ethylresorcinol,resorcinol, 4-ethyl,1,3-dihydroxy-4-ethylbenzene,4-ethyl resorcinol,2,4-dihydroxy-1-ethylbenzene,unii-8ye81t06d5,4-ethyl-benzene-1,3-diol,4-ethyl-resorcinol |
| IUPAC Name | 4-ethylbenzene-1,3-diol |
| InChI Key | VGMJYYDKPUPTID-UHFFFAOYSA-N |
| Molecular Formula | C8H10O2 |
3,4-Dihydroxybenzoic acid, 97%
CAS: 99-50-3 Molecular Formula: C7H6O4 Molecular Weight (g/mol): 154.12 MDL Number: MFCD00002509 InChI Key: YQUVCSBJEUQKSH-UHFFFAOYSA-N Synonym: protocatechuic acid,4-carboxy-1,2-dihydroxybenzene,protocatehuic acid,benzoic acid, 3,4-dihydroxy,protocatechuate,4,5-dihydroxybenzoic acid,3,4-dihydroxybenzoicacid,unii-36r5qj8l4b,ccris 6291,chembl37537 PubChem CID: 72 ChEBI: CHEBI:36062 IUPAC Name: 3,4-dihydroxybenzoic acid SMILES: C1=CC(=C(C=C1C(=O)O)O)O
| PubChem CID | 72 |
|---|---|
| CAS | 99-50-3 |
| Molecular Weight (g/mol) | 154.12 |
| ChEBI | CHEBI:36062 |
| MDL Number | MFCD00002509 |
| SMILES | C1=CC(=C(C=C1C(=O)O)O)O |
| Synonym | protocatechuic acid,4-carboxy-1,2-dihydroxybenzene,protocatehuic acid,benzoic acid, 3,4-dihydroxy,protocatechuate,4,5-dihydroxybenzoic acid,3,4-dihydroxybenzoicacid,unii-36r5qj8l4b,ccris 6291,chembl37537 |
| IUPAC Name | 3,4-dihydroxybenzoic acid |
| InChI Key | YQUVCSBJEUQKSH-UHFFFAOYSA-N |
| Molecular Formula | C7H6O4 |
Trimethylhydroquinone, 97%
CAS: 700-13-0 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00002346 InChI Key: AUFZRCJENRSRLY-UHFFFAOYSA-N Synonym: trimethylhydroquinone,2,3,5-trimethylhydroquinone,1,4-benzenediol, 2,3,5-trimethyl,pseudocumohydroquinone,psi-cumohydroquinone,2,3,6-trimethylhydroquinone,2,3,5-trimethyl-benzene-1,4-diol,hydroquinone, trimethyl,2,3,5-trimethyl-1,4-benzenediol,.psi.-cumohydroquinone PubChem CID: 12785 IUPAC Name: 2,3,5-trimethylbenzene-1,4-diol SMILES: CC1=CC(=C(C(=C1O)C)C)O
| PubChem CID | 12785 |
|---|---|
| CAS | 700-13-0 |
| Molecular Weight (g/mol) | 152.19 |
| MDL Number | MFCD00002346 |
| SMILES | CC1=CC(=C(C(=C1O)C)C)O |
| Synonym | trimethylhydroquinone,2,3,5-trimethylhydroquinone,1,4-benzenediol, 2,3,5-trimethyl,pseudocumohydroquinone,psi-cumohydroquinone,2,3,6-trimethylhydroquinone,2,3,5-trimethyl-benzene-1,4-diol,hydroquinone, trimethyl,2,3,5-trimethyl-1,4-benzenediol,.psi.-cumohydroquinone |
| IUPAC Name | 2,3,5-trimethylbenzene-1,4-diol |
| InChI Key | AUFZRCJENRSRLY-UHFFFAOYSA-N |
| Molecular Formula | C9H12O2 |
3,4-Dihydroxyphenylacetic acid, 98+%
CAS: 102-32-9 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.148 MDL Number: MFCD00004338 InChI Key: CFFZDZCDUFSOFZ-UHFFFAOYSA-N Synonym: 3,4-dihydroxyphenylacetic acid,dopac,homoprotocatechuic acid,2-3,4-dihydroxyphenyl acetic acid,dopacetic acid,benzeneacetic acid, 3,4-dihydroxy,dihydroxyphenylacetic acid,3,4-dihydroxybenzeneacetic acid,4-carboxymethylcatechol,homoprotocatechuate PubChem CID: 547 ChEBI: CHEBI:41941 IUPAC Name: 2-(3,4-dihydroxyphenyl)acetic acid SMILES: C1=CC(=C(C=C1CC(=O)O)O)O
| PubChem CID | 547 |
|---|---|
| CAS | 102-32-9 |
| Molecular Weight (g/mol) | 168.148 |
| ChEBI | CHEBI:41941 |
| MDL Number | MFCD00004338 |
| SMILES | C1=CC(=C(C=C1CC(=O)O)O)O |
| Synonym | 3,4-dihydroxyphenylacetic acid,dopac,homoprotocatechuic acid,2-3,4-dihydroxyphenyl acetic acid,dopacetic acid,benzeneacetic acid, 3,4-dihydroxy,dihydroxyphenylacetic acid,3,4-dihydroxybenzeneacetic acid,4-carboxymethylcatechol,homoprotocatechuate |
| IUPAC Name | 2-(3,4-dihydroxyphenyl)acetic acid |
| InChI Key | CFFZDZCDUFSOFZ-UHFFFAOYSA-N |
| Molecular Formula | C8H8O4 |
Catechol, 99+%
CAS: 120-80-9 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.11 MDL Number: MFCD00002188 InChI Key: YCIMNLLNPGFGHC-UHFFFAOYSA-N Synonym: pyrocatechol,catechol,1,2-dihydroxybenzene,1,2-benzenediol,pyrocatechin,2-hydroxyphenol,o-benzenediol,pyrocatechine,o-dihydroxybenzene,o-dioxybenzene PubChem CID: 289 ChEBI: CHEBI:18135 IUPAC Name: benzene-1,2-diol SMILES: OC1=CC=CC=C1O
| PubChem CID | 289 |
|---|---|
| CAS | 120-80-9 |
| Molecular Weight (g/mol) | 110.11 |
| ChEBI | CHEBI:18135 |
| MDL Number | MFCD00002188 |
| SMILES | OC1=CC=CC=C1O |
| Synonym | pyrocatechol,catechol,1,2-dihydroxybenzene,1,2-benzenediol,pyrocatechin,2-hydroxyphenol,o-benzenediol,pyrocatechine,o-dihydroxybenzene,o-dioxybenzene |
| IUPAC Name | benzene-1,2-diol |
| InChI Key | YCIMNLLNPGFGHC-UHFFFAOYSA-N |
| Molecular Formula | C6H6O2 |
2-Methylhydroquinone, 99%
CAS: 95-71-6 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.14 MDL Number: MFCD00002345 InChI Key: CNHDIAIOKMXOLK-UHFFFAOYSA-N Synonym: methylhydroquinone,2-methylhydroquinone,2,5-dihydroxytoluene,p-toluhydroquinone,toluhydroquinone,toluquinol,p-toluquinol,tolylhydroquinone,p-toluhydroquinol,2,5-toluenediol PubChem CID: 7253 IUPAC Name: 2-methylbenzene-1,4-diol SMILES: CC1=CC(O)=CC=C1O
| PubChem CID | 7253 |
|---|---|
| CAS | 95-71-6 |
| Molecular Weight (g/mol) | 124.14 |
| MDL Number | MFCD00002345 |
| SMILES | CC1=CC(O)=CC=C1O |
| Synonym | methylhydroquinone,2-methylhydroquinone,2,5-dihydroxytoluene,p-toluhydroquinone,toluhydroquinone,toluquinol,p-toluquinol,tolylhydroquinone,p-toluhydroquinol,2,5-toluenediol |
| IUPAC Name | 2-methylbenzene-1,4-diol |
| InChI Key | CNHDIAIOKMXOLK-UHFFFAOYSA-N |
| Molecular Formula | C7H8O2 |
o-Orsellinic acid hydrate, 98%
CAS: 480-64-8 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.15 MDL Number: MFCD16661187 InChI Key: AMKYESDOVDKZKV-UHFFFAOYSA-N Synonym: orsellinic acid,orsellic acid,o-orsellinic acid,orcinolcarboxylic acid,4,6-dihydroxy-o-toluic acid,unii-11xla0494b,benzoic acid, 2,4-dihydroxy-6-methyl,2,4-dihydroxy-6-methyl-benzoic acid,orsellinate,4,6-dihydroxy-2-methylbenzoic acid PubChem CID: 68072 ChEBI: CHEBI:32807 IUPAC Name: 2,4-dihydroxy-6-methylbenzoic acid SMILES: CC1=CC(O)=CC(O)=C1C(O)=O
| PubChem CID | 68072 |
|---|---|
| CAS | 480-64-8 |
| Molecular Weight (g/mol) | 168.15 |
| ChEBI | CHEBI:32807 |
| MDL Number | MFCD16661187 |
| SMILES | CC1=CC(O)=CC(O)=C1C(O)=O |
| Synonym | orsellinic acid,orsellic acid,o-orsellinic acid,orcinolcarboxylic acid,4,6-dihydroxy-o-toluic acid,unii-11xla0494b,benzoic acid, 2,4-dihydroxy-6-methyl,2,4-dihydroxy-6-methyl-benzoic acid,orsellinate,4,6-dihydroxy-2-methylbenzoic acid |
| IUPAC Name | 2,4-dihydroxy-6-methylbenzoic acid |
| InChI Key | AMKYESDOVDKZKV-UHFFFAOYSA-N |
| Molecular Formula | C8H8O4 |
L-Adrenaline, 98+%
CAS: 51-43-4 Molecular Formula: C9H13NO3 Molecular Weight (g/mol): 183.207 MDL Number: MFCD00002204 InChI Key: UCTWMZQNUQWSLP-VIFPVBQESA-N Synonym: epinephrine,l-adrenaline,adrenaline,l-epinephrine,adrenalin,levoepinephrine,epinefrina,--adrenaline,adnephrine,chelafrin PubChem CID: 5816 ChEBI: CHEBI:28918 IUPAC Name: 4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol SMILES: CNCC(C1=CC(=C(C=C1)O)O)O
| PubChem CID | 5816 |
|---|---|
| CAS | 51-43-4 |
| Molecular Weight (g/mol) | 183.207 |
| ChEBI | CHEBI:28918 |
| MDL Number | MFCD00002204 |
| SMILES | CNCC(C1=CC(=C(C=C1)O)O)O |
| Synonym | epinephrine,l-adrenaline,adrenaline,l-epinephrine,adrenalin,levoepinephrine,epinefrina,--adrenaline,adnephrine,chelafrin |
| IUPAC Name | 4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol |
| InChI Key | UCTWMZQNUQWSLP-VIFPVBQESA-N |
| Molecular Formula | C9H13NO3 |
Resorcinol, ACS, 99.0-100.5%
CAS: 108-46-3 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.112 MDL Number: MFCD00002269 InChI Key: GHMLBKRAJCXXBS-UHFFFAOYSA-N Synonym: resorcinol,1,3-benzenediol,resorcin,1,3-dihydroxybenzene,3-hydroxyphenol,m-hydroquinone,resorcine,m-dihydroxybenzene,m-hydroxyphenol,m-benzenediol PubChem CID: 5054 ChEBI: CHEBI:27810 IUPAC Name: benzene-1,3-diol SMILES: C1=CC(=CC(=C1)O)O
| PubChem CID | 5054 |
|---|---|
| CAS | 108-46-3 |
| Molecular Weight (g/mol) | 110.112 |
| ChEBI | CHEBI:27810 |
| MDL Number | MFCD00002269 |
| SMILES | C1=CC(=CC(=C1)O)O |
| Synonym | resorcinol,1,3-benzenediol,resorcin,1,3-dihydroxybenzene,3-hydroxyphenol,m-hydroquinone,resorcine,m-dihydroxybenzene,m-hydroxyphenol,m-benzenediol |
| IUPAC Name | benzene-1,3-diol |
| InChI Key | GHMLBKRAJCXXBS-UHFFFAOYSA-N |
| Molecular Formula | C6H6O2 |
4-Chlororesorcinol, 98%
CAS: 95-88-5 Molecular Formula: C6H5ClO2 Molecular Weight (g/mol): 144.55 MDL Number: MFCD00002273 InChI Key: JQVAPEJNIZULEK-UHFFFAOYSA-N Synonym: 4-chlororesorcinol,1,3-benzenediol, 4-chloro,p-chlororesorcinol,4-chlororesorcin,resorcinol, 4-chloro,6-chlororesorcinol,4-chloro-1,3-dihydroxybenzene,4-chloro-1,3-benzenediol,2,4-dihydroxychlorobenzene,1,3-dihydroxy-4-chlorobenzene PubChem CID: 1731 IUPAC Name: 4-chlorobenzene-1,3-diol SMILES: OC1=CC=C(Cl)C(O)=C1
| PubChem CID | 1731 |
|---|---|
| CAS | 95-88-5 |
| Molecular Weight (g/mol) | 144.55 |
| MDL Number | MFCD00002273 |
| SMILES | OC1=CC=C(Cl)C(O)=C1 |
| Synonym | 4-chlororesorcinol,1,3-benzenediol, 4-chloro,p-chlororesorcinol,4-chlororesorcin,resorcinol, 4-chloro,6-chlororesorcinol,4-chloro-1,3-dihydroxybenzene,4-chloro-1,3-benzenediol,2,4-dihydroxychlorobenzene,1,3-dihydroxy-4-chlorobenzene |
| IUPAC Name | 4-chlorobenzene-1,3-diol |
| InChI Key | JQVAPEJNIZULEK-UHFFFAOYSA-N |
| Molecular Formula | C6H5ClO2 |
4-Ethylcatechol, 98%
CAS: 1124-39-6 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00015847 InChI Key: HFLGBNBLMBSXEM-UHFFFAOYSA-N Synonym: 4-ethylcatechol,4-ethylpyrocatechol,4-ethyl-1,2-benzenediol,unii-574jv8byr2,1,2-benzenediol, 4-ethyl,benzenediol, 4-ethyl,3,4-dihydroxyethylbenzene,ethylcatechol,4-ethyl catechol,4-ethylc atechol PubChem CID: 70761 IUPAC Name: 4-ethylbenzene-1,2-diol SMILES: CCC1=CC=C(O)C(O)=C1
| PubChem CID | 70761 |
|---|---|
| CAS | 1124-39-6 |
| Molecular Weight (g/mol) | 138.17 |
| MDL Number | MFCD00015847 |
| SMILES | CCC1=CC=C(O)C(O)=C1 |
| Synonym | 4-ethylcatechol,4-ethylpyrocatechol,4-ethyl-1,2-benzenediol,unii-574jv8byr2,1,2-benzenediol, 4-ethyl,benzenediol, 4-ethyl,3,4-dihydroxyethylbenzene,ethylcatechol,4-ethyl catechol,4-ethylc atechol |
| IUPAC Name | 4-ethylbenzene-1,2-diol |
| InChI Key | HFLGBNBLMBSXEM-UHFFFAOYSA-N |
| Molecular Formula | C8H10O2 |
3,4-Dihydroxycinnamic acid, predominantly trans, 98+%
CAS: 331-39-5 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.159 MDL Number: MFCD00004392 InChI Key: QAIPRVGONGVQAS-DUXPYHPUSA-N Synonym: caffeic acid,3,4-dihydroxycinnamic acid,3-3,4-dihydroxyphenyl acrylic acid,trans-caffeate,3,4-dihydroxy-trans-cinnamate,2e-3-3,4-dihydroxyphenyl prop-2-enoic acid,3,4-dihydroxybenzeneacrylic acid,e-3-3,4-dihydroxyphenyl acrylic acid,trans-caffeic acid,3-3,4-dihydroxyphenyl propenoic acid PubChem CID: 689043 ChEBI: CHEBI:16433 IUPAC Name: (E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid SMILES: C1=CC(=C(C=C1C=CC(=O)O)O)O
| PubChem CID | 689043 |
|---|---|
| CAS | 331-39-5 |
| Molecular Weight (g/mol) | 180.159 |
| ChEBI | CHEBI:16433 |
| MDL Number | MFCD00004392 |
| SMILES | C1=CC(=C(C=C1C=CC(=O)O)O)O |
| Synonym | caffeic acid,3,4-dihydroxycinnamic acid,3-3,4-dihydroxyphenyl acrylic acid,trans-caffeate,3,4-dihydroxy-trans-cinnamate,2e-3-3,4-dihydroxyphenyl prop-2-enoic acid,3,4-dihydroxybenzeneacrylic acid,e-3-3,4-dihydroxyphenyl acrylic acid,trans-caffeic acid,3-3,4-dihydroxyphenyl propenoic acid |
| IUPAC Name | (E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid |
| InChI Key | QAIPRVGONGVQAS-DUXPYHPUSA-N |
| Molecular Formula | C9H8O4 |