Cinnamic acids and derivatives
(E)-3,4-Dihydroxybenzylideneacetone, 97%
CAS: 123694-03-1 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.187 MDL Number: MFCD00916691 InChI Key: YIFZKRGUGKLILR-UHFFFAOYSA-N Synonym: 3-buten-2-one,4-3,4-dihydroxyphenyl-, 3e,3,4-dihydroxybenzalacetone,acmc-20dpit PubChem CID: 53446072 IUPAC Name: 4-(3,4-dihydroxyphenyl)but-3-en-2-one SMILES: CC(=O)C=CC1=CC(=C(C=C1)O)O
trans-4-Hydroxy-3-methoxycinnamic acid, 99%
CAS: 537-98-4 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00004400 InChI Key: KSEBMYQBYZTDHS-HWKANZROSA-N Synonym: ferulic acid,trans-ferulic acid,4-hydroxy-3-methoxycinnamic acid,trans-4-hydroxy-3-methoxycinnamic acid,3-4-hydroxy-3-methoxyphenyl acrylic acid,e-ferulic acid,coniferic acid,ferulate,ferulic acid, trans,2-propenoic acid, 3-4-hydroxy-3-methoxyphenyl PubChem CID: 445858 ChEBI: CHEBI:17620 IUPAC Name: (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid SMILES: COC1=CC(\C=C\C(O)=O)=CC=C1O
trans-4-Hydroxycinnamic acid, 98%
CAS: 501-98-4 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 MDL Number: MFCD00004399 InChI Key: NGSWKAQJJWESNS-ZZXKWVIFSA-N Synonym: p-coumaric acid,4-hydroxycinnamic acid,p-hydroxycinnamic acid,4-coumaric acid,trans-4-hydroxycinnamic acid,trans-p-coumaric acid,p-cumaric acid,3-4-hydroxyphenyl acrylic acid,para-coumaric acid,hydroxycinnamic acid PubChem CID: 637542 ChEBI: CHEBI:32374 IUPAC Name: (E)-3-(4-hydroxyphenyl)prop-2-enoic acid SMILES: C1=CC(=CC=C1C=CC(=O)O)O
2-Carboxycinnamic acid, predominantly trans, 97%
CAS: 612-40-8 Molecular Formula: C10H8O4 Molecular Weight (g/mol): 192.17 MDL Number: MFCD00004380 InChI Key: SCWPNMHQRGNQHH-AATRIKPKSA-N Synonym: 2-carboxycinnamic acid,2-2-carboxyvinyl benzoic acid,2-2-carboxyethenyl benzoic acid,e-2-2-carboxyvinyl benzoic acid,2-e-3-hydroxy-3-oxoprop-1-enyl benzoic acid,2-1e-2-carboxyvinyl benzoic acid,2-e-2-carboxyethenyl benzoic acid,2-1e-2-carboxyeth-1-en-1-yl benzoic acid,2-e-2-carboxyvinyl benzoicacid,2-carboxy cinnamic acid PubChem CID: 904938 IUPAC Name: 2-[(E)-2-carboxyethenyl]benzoic acid SMILES: OC(=O)\C=C\C1=CC=CC=C1C(O)=O
3-(Trifluoromethyl)cinnamic acid, predominantly trans, 98+%
CAS: 779-89-5 Molecular Formula: C10H7F3O2 Molecular Weight (g/mol): 216.159 MDL Number: MFCD00004393 InChI Key: KSBWHDDGWSYETA-SNAWJCMRSA-N Synonym: 3-trifluoromethyl cinnamic acid,3-3-trifluoromethyl phenyl acrylic acid,m-trifluoromethyl cinnamic acid,e-3-trifluoromethyl cinnamic acid,unii-p9lj9on37w,2e-3-3-trifluoromethyl phenyl prop-2-enoic acid,e-m-trifluoromethyl cinnamic acid,3-e-trifluoromethyl cinnamic acid PubChem CID: 719451 ChEBI: CHEBI:60704 IUPAC Name: (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoic acid SMILES: C1=CC(=CC(=C1)C(F)(F)F)C=CC(=O)O
trans-2-Methoxycinnamic acid, 98+%
CAS: 1011-54-7 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.187 MDL Number: MFCD00064238 InChI Key: FEGVSPGUHMGGBO-VOTSOKGWSA-N Synonym: 2-methoxycinnamic acid,trans-2-methoxycinnamic acid,3-2-methoxyphenyl acrylic acid,2e-3-2-methoxyphenyl acrylic acid,2e-3-2-methoxyphenyl prop-2-enoic acid,o-methoxycinnamic acid,e-3-2-methoxyphenyl acrylic acid,e-3-2-methoxyphenyl-2-propenoic acid,e-o-methoxycinnamic acid,trans-o-methyl-o-coumaric acid PubChem CID: 734154 IUPAC Name: (E)-3-(2-methoxyphenyl)prop-2-enoic acid SMILES: COC1=CC=CC=C1C=CC(=O)O
2,3-Dimethoxycinnamic acid, predominantly trans, 98+%
CAS: 7345-82-6 Molecular Formula: C11H12O4 Molecular Weight (g/mol): 208.213 MDL Number: MFCD00004376 InChI Key: QAXPUWGAGVERSJ-VOTSOKGWSA-N Synonym: 2,3-dimethoxycinnamic acid,trans-2,3-dimethoxycinnamic acid,2e-3-2,3-dimethoxyphenyl acrylic acid,e-3-2,3-dimethoxyphenyl acrylic acid,2,3-dimethoxy cinnamic acid,3-2,3-dimethoxyphenyl acrylic acid,2e-3-2,3-dimethoxyphenyl prop-2-enoic acid,2-propenoic acid, 3-2,3-dimethoxyphenyl,e-3-2,3-dimethoxyphenyl prop-2-enoic acid,e-3-2,3-dimethoxy-phenyl-acrylic acid PubChem CID: 735842 IUPAC Name: (E)-3-(2,3-dimethoxyphenyl)prop-2-enoic acid SMILES: COC1=CC=CC(=C1OC)C=CC(=O)O
alpha-Methylcinnamic acid, 99%
CAS: 1199-77-5 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00002652 InChI Key: XNCRUNXWPDJHGV-BQYQJAHWSA-N Synonym: alpha-methylcinnamic acid,2-methyl-3-phenylacrylic acid,2e-2-methyl-3-phenylprop-2-enoic acid,a-methylcinnamic acid,2e-2-methyl-3-phenylacrylic acid,.alpha.-methylcinnamic acid,e-2-methyl-3-phenylacrylic acid,2-propenoic acid, 2-methyl-3-phenyl,alpha-methyl cinnamic acid,e-2-methyl-3-phenylprop-2-enoic acid PubChem CID: 637817 IUPAC Name: (E)-2-methyl-3-phenylprop-2-enoic acid SMILES: C\C(=C/C1=CC=CC=C1)C(O)=O
4-Chlorocinnamamide, 97%
CAS: 18166-64-8 Molecular Formula: C9H8ClNO Molecular Weight (g/mol): 181.62 MDL Number: MFCD00017147 InChI Key: PWXPFYVNYKVJBW-ZZXKWVIFSA-N Synonym: 4-chlorocinnamamide,p-chlorocinnamamide,2e-3-4-chlorophenyl prop-2-enamide,3-4-chlorophenyl acrylamide,p-chlorocinnamide,4-chlorocinnamide,trans,4-chlorobenzeneacrylamide,2e-3-4-chlorophenyl acrylamide,e-3-4-chlorophenyl prop-2-enamide PubChem CID: 5364144 IUPAC Name: (E)-3-(4-chlorophenyl)prop-2-enamide SMILES: NC(=O)\C=C\C1=CC=C(Cl)C=C1
4-Methoxycinnamic acid, 99%
CAS: 830-09-1 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.187 MDL Number: MFCD00004398 InChI Key: AFDXODALSZRGIH-QPJJXVBHSA-N Synonym: 4-methoxycinnamic acid,p-methoxycinnamic acid,3-4-methoxyphenyl acrylic acid,trans-4-methoxycinnamic acid,4-methoxycinnamate,para-methoxycinnamic acid,o-methyl-p-coumaric acid,cinnamic acid, p-methoxy,e-3-4-methoxyphenyl acrylic acid,e-3-4-methoxyphenyl-2-propenoic acid PubChem CID: 699414 IUPAC Name: (E)-3-(4-methoxyphenyl)prop-2-enoic acid SMILES: COC1=CC=C(C=C1)C=CC(=O)O
4-Methylcinnamic acid, predominantly trans, 99%
CAS: 1866-39-3 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.188 MDL Number: MFCD00002697 InChI Key: RURHILYUWQEGOS-VOTSOKGWSA-N Synonym: 4-methylcinnamic acid,3-p-tolyl acrylic acid,e-3-p-tolyl acrylic acid,p-methylcinnamic acid,p-methyl cinnamic acid,2e-3-4-methylphenyl acrylic acid,2e-3-4-methylphenyl prop-2-enoic acid,4-methyl-cinnamic acid,e-3-4-methylphenyl-2-propenoic acid,3-4-methylphenyl-2-propenoic acid PubChem CID: 731767 IUPAC Name: (E)-3-(4-methylphenyl)prop-2-enoic acid SMILES: CC1=CC=C(C=C1)C=CC(=O)O
trans-3-Fluorocinnamic acid, 98%
CAS: 20595-30-6 Molecular Formula: C9H7FO2 Molecular Weight (g/mol): 166.151 MDL Number: MFCD00004383 InChI Key: RTSIUKMGSDOSTI-SNAWJCMRSA-N Synonym: 3-fluorocinnamic acid,3-3-fluorophenyl acrylic acid,trans-3-fluorocinnamic acid,2e-3-3-fluorophenyl prop-2-enoic acid,e-3-3-fluorophenyl acrylic acid,m-fluorocinnamic acid,trans 3-fluorocinnamic acid,3-3-fluoro-phenyl-acrylic acid,trans-m-fluorocinnamic,e-3-3-fluorophenyl prop-2-enoic acid PubChem CID: 1551219 IUPAC Name: (E)-3-(3-fluorophenyl)prop-2-enoic acid SMILES: C1=CC(=CC(=C1)F)C=CC(=O)O
Cinnamamide, predominantly trans, 97%
CAS: 621-79-4 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.177 MDL Number: MFCD00008033 InChI Key: APEJMQOBVMLION-VOTSOKGWSA-N Synonym: cinnamamide,trans-cinnamamide,3-phenylacrylamide,cinnamic amide,2-propenamide, 3-phenyl,3-phenylpropenamide,2-benzylideneacetamide,e-cinnamamide,ginnamic acid amide,trans-cinnamoylamine PubChem CID: 5273472 ChEBI: CHEBI:76320 IUPAC Name: (E)-3-phenylprop-2-enamide SMILES: C1=CC=C(C=C1)C=CC(=O)N
4-Ethoxycinnamic acid, prediminantly trans, 98+%
CAS: 2373-79-7 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 MDL Number: MFCD00016848 InChI Key: DZLOUWYGNATKKZ-VMPITWQZSA-N Synonym: 4-ethoxycinnamic acid,3-4-ethoxyphenyl acrylic acid,2e-3-4-ethoxyphenyl acrylic acid,2e-3-4-ethoxyphenyl prop-2-enoic acid,e-3-4-ethoxyphenyl acrylic acid,e-3-4-ethoxyphenyl prop-2-enoic acid,4-ethoxyphenylacrylic acid,p-ethoxycinnamic acid,ethoxyphenylacrylicacid,pubchem8239 PubChem CID: 704218 IUPAC Name: (E)-3-(4-ethoxyphenyl)prop-2-enoic acid SMILES: CCOC1=CC=C(C=C1)C=CC(=O)O