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Phenylpropanoids and polyketides

Phenylpropaniods are organic compounds characterized by having an aromatic ring and a three-carbon propene tail. Polyketides are compounds characterized by having two or more carbonyl functional groups connected with a single carbon atom.
Cinnamic acids and derivatives (267)
Coumarins and derivatives (263)
Flavonoids (174)
Phenylpropanoic acids (166)
Linear 1 3-diarylpropanoids (140)
Depsides and depsidones (69)
Stilbenes (60)
Cinnamaldehydes (42)
Isoflavonoids (41)
Isocoumarins and derivatives (18)
Cinnamyl alcohols (16)
Tetracyclines (10)
Anthracyclines (7)
Dihydrocoumarins (5)
Macrolide lactams (4)
Macrolactams (3)
Macrolides and analogues (2)
Neoflavonoids (2)
Angucyclines (1)
Ochratoxins and related substances (1)

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1 – 15 of 679 results
1

4-Hydroxy-3-methoxycinnamic acid, 99%

CAS: 1135-24-6 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=C(C=CC(=C1)C=CC(=O)O)O

PubChem CID 445858
CAS 1135-24-6
Molecular Weight (g/mol) 194.19
ChEBI CHEBI:17620
MDL Number MFCD00004400
SMILES COC1=C(C=CC(=C1)C=CC(=O)O)O
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
IUPAC Name (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid
InChI Key KSEBMYQBYZTDHS-HWKANZROSA-N
Molecular Formula C10H10O4
2

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

PubChem CID 719451
CAS 779-89-5
Molecular Weight (g/mol) 216.159
ChEBI CHEBI:60704
MDL Number MFCD00004393
SMILES C1=CC(=CC(=C1)C(F)(F)F)C=CC(=O)O
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
IUPAC Name (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoic acid
InChI Key KSBWHDDGWSYETA-SNAWJCMRSA-N
Molecular Formula C10H7F3O2
3

Thermo Scientific Chemicals Curcumin (mixture of curcumin, demethoxycurcumin, and bisdemethoxycurcumin), 96%

CAS: 458-37-7 Molecular Formula: C21H20O6 Molecular Weight (g/mol): 368.39 MDL Number: MFCD00008365 InChI Key: ZIUSSTSXXLLKKK-KOBPDPAPSA-N Synonym: curcumin,diferuloylmethane,natural yellow 3,turmeric yellow,turmeric,curcuma,kacha haldi,gelbwurz,halad,curcumin i PubChem CID: 969516 ChEBI: CHEBI:3962 SMILES: COC1=CC(\C=C\C(\O)=C\C(=O)\C=C\C2=CC=C(O)C(OC)=C2)=CC=C1O

PubChem CID 969516
CAS 458-37-7
Molecular Weight (g/mol) 368.39
ChEBI CHEBI:3962
MDL Number MFCD00008365
SMILES COC1=CC(\C=C\C(\O)=C\C(=O)\C=C\C2=CC=C(O)C(OC)=C2)=CC=C1O
Synonym curcumin,diferuloylmethane,natural yellow 3,turmeric yellow,turmeric,curcuma,kacha haldi,gelbwurz,halad,curcumin i
InChI Key ZIUSSTSXXLLKKK-KOBPDPAPSA-N
Molecular Formula C21H20O6
4

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

PubChem CID 445858
CAS 537-98-4
Molecular Weight (g/mol) 194.19
ChEBI CHEBI:17620
MDL Number MFCD00004400
SMILES COC1=CC(\C=C\C(O)=O)=CC=C1O
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
IUPAC Name (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid
InChI Key KSEBMYQBYZTDHS-HWKANZROSA-N
Molecular Formula C10H10O4
5

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

PubChem CID 735842
CAS 7345-82-6
Molecular Weight (g/mol) 208.213
MDL Number MFCD00004376
SMILES COC1=CC=CC(=C1OC)C=CC(=O)O
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
IUPAC Name (E)-3-(2,3-dimethoxyphenyl)prop-2-enoic acid
InChI Key QAXPUWGAGVERSJ-VOTSOKGWSA-N
Molecular Formula C11H12O4
6

4-Dimethylaminocinnamic acid, 97+%

CAS: 1552-96-1 Molecular Formula: C11H13NO2 Molecular Weight (g/mol): 191.23 MDL Number: MFCD00004397 InChI Key: CQNPVMCASGWEHM-VMPITWQZSA-N Synonym: 4-dimethylamino cinnamic acid,4-dimethylaminocinnamic acid,p-dimethylamino cinnamic acid,3-4-dimethylamino phenyl acrylic acid,4-n,n-dimethylamino cinnamic acid,2e-3-4-dimethylamino phenyl prop-2-enoic acid,e-3-4-dimethylaminophenyl prop-2-enoic acid,e-3-4-dimethylamino phenyl acrylic acid PubChem CID: 1540638 IUPAC Name: (E)-3-[4-(dimethylamino)phenyl]prop-2-enoic acid SMILES: CN(C)C1=CC=C(C=C1)C=CC(=O)O

PubChem CID 1540638
CAS 1552-96-1
Molecular Weight (g/mol) 191.23
MDL Number MFCD00004397
SMILES CN(C)C1=CC=C(C=C1)C=CC(=O)O
Synonym 4-dimethylamino cinnamic acid,4-dimethylaminocinnamic acid,p-dimethylamino cinnamic acid,3-4-dimethylamino phenyl acrylic acid,4-n,n-dimethylamino cinnamic acid,2e-3-4-dimethylamino phenyl prop-2-enoic acid,e-3-4-dimethylaminophenyl prop-2-enoic acid,e-3-4-dimethylamino phenyl acrylic acid
IUPAC Name (E)-3-[4-(dimethylamino)phenyl]prop-2-enoic acid
InChI Key CQNPVMCASGWEHM-VMPITWQZSA-N
Molecular Formula C11H13NO2
7

3,5-Dimethoxy-4-hydroxycinnamic acid, 98%, predominantly trans isomer

CAS: 530-59-6 Molecular Formula: C11H12O5 Molecular Weight (g/mol): 224.21 InChI Key: PCMORTLOPMLEFB-ONEGZZNKSA-N Synonym: sinapic acid,sinapinic acid,3,5-dimethoxy-4-hydroxycinnamic acid,sinapinate,sinapate,trans-sinapic acid,4-hydroxy-3,5-dimethoxycinnamic acid,synapoic acid,2e-3-4-hydroxy-3,5-dimethoxyphenyl prop-2-enoic acid,unii-p0i60993ec PubChem CID: 637775 ChEBI: CHEBI:15714 IUPAC Name: (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid SMILES: COC1=CC(=CC(=C1O)OC)C=CC(=O)O

PubChem CID 637775
CAS 530-59-6
Molecular Weight (g/mol) 224.21
ChEBI CHEBI:15714
SMILES COC1=CC(=CC(=C1O)OC)C=CC(=O)O
Synonym sinapic acid,sinapinic acid,3,5-dimethoxy-4-hydroxycinnamic acid,sinapinate,sinapate,trans-sinapic acid,4-hydroxy-3,5-dimethoxycinnamic acid,synapoic acid,2e-3-4-hydroxy-3,5-dimethoxyphenyl prop-2-enoic acid,unii-p0i60993ec
IUPAC Name (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid
InChI Key PCMORTLOPMLEFB-ONEGZZNKSA-N
Molecular Formula C11H12O5
8

phyproof™ trans-Cinnamic acid, ≥98% (HPLC), MilliporeSigma™ Supelco™

This substance is a primary reference substance with assigned absolute purity (considering chromatographic purity, water, residual solvents, inorganic impurities). The exact value can be found on the certificate. Produced by PhytoLab GmbH & Co. KG

9

4-Hydroxy-3,5-dimethoxycinnamic acid, 98%

CAS: 530-59-6 Molecular Formula: C11H12O5 Molecular Weight (g/mol): 224.212 MDL Number: MFCD00004401 InChI Key: PCMORTLOPMLEFB-ONEGZZNKSA-N Synonym: sinapic acid,sinapinic acid,3,5-dimethoxy-4-hydroxycinnamic acid,sinapinate,sinapate,trans-sinapic acid,4-hydroxy-3,5-dimethoxycinnamic acid,synapoic acid,2e-3-4-hydroxy-3,5-dimethoxyphenyl prop-2-enoic acid,unii-p0i60993ec PubChem CID: 637775 ChEBI: CHEBI:15714 IUPAC Name: (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid SMILES: COC1=CC(=CC(=C1O)OC)C=CC(=O)O

PubChem CID 637775
CAS 530-59-6
Molecular Weight (g/mol) 224.212
ChEBI CHEBI:15714
MDL Number MFCD00004401
SMILES COC1=CC(=CC(=C1O)OC)C=CC(=O)O
Synonym sinapic acid,sinapinic acid,3,5-dimethoxy-4-hydroxycinnamic acid,sinapinate,sinapate,trans-sinapic acid,4-hydroxy-3,5-dimethoxycinnamic acid,synapoic acid,2e-3-4-hydroxy-3,5-dimethoxyphenyl prop-2-enoic acid,unii-p0i60993ec
IUPAC Name (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid
InChI Key PCMORTLOPMLEFB-ONEGZZNKSA-N
Molecular Formula C11H12O5
10

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

PubChem CID 699414
CAS 830-09-1
Molecular Weight (g/mol) 178.187
MDL Number MFCD00004398
SMILES COC1=CC=C(C=C1)C=CC(=O)O
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
IUPAC Name (E)-3-(4-methoxyphenyl)prop-2-enoic acid
InChI Key AFDXODALSZRGIH-QPJJXVBHSA-N
Molecular Formula C10H10O3
11

3-Methylcinnamic acid, 98%, Thermo Scientific™

CAS: 3029-79-6 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00016844 InChI Key: JZINNAKNHHQBOS-AATRIKPKSA-N Synonym: 3-methylcinnamic acid,m-methylcinnamic acid,e-3-m-tolyl acrylic acid,3-m-tolyl acrylic acid,2e-3-3-methylphenyl acrylic acid,2e-3-3-methylphenyl prop-2-enoic acid,cinnamic acid, m-methyl,3-methylcinnamic acid, predominantly trans,2e-3-3-methylphenyl-2-propenoic acid,2-propenoic acid, 3-3-methylphenyl-, 2e PubChem CID: 2063448 ChEBI: CHEBI:61118 IUPAC Name: (E)-3-(3-methylphenyl)prop-2-enoic acid SMILES: CC1=CC=CC(=C1)C=CC(=O)O

PubChem CID 2063448
CAS 3029-79-6
Molecular Weight (g/mol) 162.19
ChEBI CHEBI:61118
MDL Number MFCD00016844
SMILES CC1=CC=CC(=C1)C=CC(=O)O
Synonym 3-methylcinnamic acid,m-methylcinnamic acid,e-3-m-tolyl acrylic acid,3-m-tolyl acrylic acid,2e-3-3-methylphenyl acrylic acid,2e-3-3-methylphenyl prop-2-enoic acid,cinnamic acid, m-methyl,3-methylcinnamic acid, predominantly trans,2e-3-3-methylphenyl-2-propenoic acid,2-propenoic acid, 3-3-methylphenyl-, 2e
IUPAC Name (E)-3-(3-methylphenyl)prop-2-enoic acid
InChI Key JZINNAKNHHQBOS-AATRIKPKSA-N
Molecular Formula C10H10O2
12

alpha-Cyano-4-hydroxycinnamic acid, Ultrapure MALDI Matrix, Thermo Scientific Chemicals

CAS: 28166-41-8 Molecular Formula: C10H7NO3 Molecular Weight (g/mol): 189.17 MDL Number: MFCD00004204 InChI Key: AFVLVVWMAFSXCK-YVMONPNESA-N Synonym: alpha-cyano-4-hydroxycinnamate,2-cyano-4-hydroxycinnamate,2-cyano-3-4-hydroxyphe-nyl acrylic acid,2z-2-cyano-3-4-hydroxyphenyl prop-2-enoic acid PubChem CID: 9794103 IUPAC Name: (Z)-2-cyano-3-(4-hydroxyphenyl)prop-2-enoic acid SMILES: C1=CC(=CC=C1C=C(C#N)C(=O)O)O

PubChem CID 9794103
CAS 28166-41-8
Molecular Weight (g/mol) 189.17
MDL Number MFCD00004204
SMILES C1=CC(=CC=C1C=C(C#N)C(=O)O)O
Synonym alpha-cyano-4-hydroxycinnamate,2-cyano-4-hydroxycinnamate,2-cyano-3-4-hydroxyphe-nyl acrylic acid,2z-2-cyano-3-4-hydroxyphenyl prop-2-enoic acid
IUPAC Name (Z)-2-cyano-3-(4-hydroxyphenyl)prop-2-enoic acid
InChI Key AFVLVVWMAFSXCK-YVMONPNESA-N
Molecular Formula C10H7NO3
13

4-Acetoxy-3-methoxycinnamic acid, 98+%

CAS: 2596-47-6 Molecular Formula: C12H12O5 Molecular Weight (g/mol): 236.223 MDL Number: MFCD00014378 InChI Key: IHKNVZISLLDMOR-GQCTYLIASA-N Synonym: acetylferulic acid,4-acetoxy-3-methoxycinnamic acid,3-methoxy-4-acetoxycinnamic acid,3-4-acetoxy-3-methoxyphenyl acrylic acid,cinnamic acid, 4-acetoxy-3-methoxy,acetylated ferulic acid,cinnamic acid, 4-hydroxy-3-methoxy-, acetate,2-propenoic acid, 3-4-acetyloxy-3-methoxyphenyl,2e-3-4-acetyloxy-3-methoxyphenyl prop-2-enoic acid PubChem CID: 5354677 ChEBI: CHEBI:86582 IUPAC Name: (E)-3-(4-acetyloxy-3-methoxyphenyl)prop-2-enoic acid SMILES: CC(=O)OC1=C(C=C(C=C1)C=CC(=O)O)OC

PubChem CID 5354677
CAS 2596-47-6
Molecular Weight (g/mol) 236.223
ChEBI CHEBI:86582
MDL Number MFCD00014378
SMILES CC(=O)OC1=C(C=C(C=C1)C=CC(=O)O)OC
Synonym acetylferulic acid,4-acetoxy-3-methoxycinnamic acid,3-methoxy-4-acetoxycinnamic acid,3-4-acetoxy-3-methoxyphenyl acrylic acid,cinnamic acid, 4-acetoxy-3-methoxy,acetylated ferulic acid,cinnamic acid, 4-hydroxy-3-methoxy-, acetate,2-propenoic acid, 3-4-acetyloxy-3-methoxyphenyl,2e-3-4-acetyloxy-3-methoxyphenyl prop-2-enoic acid
IUPAC Name (E)-3-(4-acetyloxy-3-methoxyphenyl)prop-2-enoic acid
InChI Key IHKNVZISLLDMOR-GQCTYLIASA-N
Molecular Formula C12H12O5
14

3,5-Di-tert-butyl-4-hydroxycinnamic acid, predominantly trans, 97%

CAS: 22014-01-3 Molecular Formula: C17H24O3 Molecular Weight (g/mol): 276.38 MDL Number: MFCD00017291 InChI Key: CTYWXRDQWMRIIM-BQYQJAHWSA-N Synonym: 3-3,5-di-tert-butyl-4-hydroxyphenyl acrylic acid,unii-k7zj1m9j5t,k7zj1m9j5t,3,5-di-tert-butyl-4-hydroxycinnamic acid,3,5-di-t-butyl-4-hydroxycinnamic acid,3,5-di-tert-butyl-4-hydroxycinnamic acid, predominantly trans,2e-3-3,5-di-tert-butyl-4-hydroxyphenyl prop-2-enoic acid,3-3,5-di-tert-butyl-4-hydroxyphenyl prop-2-enoic acid,2e-3-3,5-bis tert-butyl-4-hydroxyphenyl prop-2-enoic acid,2e-3-3,5-ditert-butyl-4-hydroxyphenyl acrylic acid PubChem CID: 689095 IUPAC Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enoic acid SMILES: CC(C)(C)C1=CC(\C=C\C(O)=O)=CC(=C1O)C(C)(C)C

PubChem CID 689095
CAS 22014-01-3
Molecular Weight (g/mol) 276.38
MDL Number MFCD00017291
SMILES CC(C)(C)C1=CC(\C=C\C(O)=O)=CC(=C1O)C(C)(C)C
Synonym 3-3,5-di-tert-butyl-4-hydroxyphenyl acrylic acid,unii-k7zj1m9j5t,k7zj1m9j5t,3,5-di-tert-butyl-4-hydroxycinnamic acid,3,5-di-t-butyl-4-hydroxycinnamic acid,3,5-di-tert-butyl-4-hydroxycinnamic acid, predominantly trans,2e-3-3,5-di-tert-butyl-4-hydroxyphenyl prop-2-enoic acid,3-3,5-di-tert-butyl-4-hydroxyphenyl prop-2-enoic acid,2e-3-3,5-bis tert-butyl-4-hydroxyphenyl prop-2-enoic acid,2e-3-3,5-ditert-butyl-4-hydroxyphenyl acrylic acid
IUPAC Name (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enoic acid
InChI Key CTYWXRDQWMRIIM-BQYQJAHWSA-N
Molecular Formula C17H24O3
15

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

PubChem CID 5364144
CAS 18166-64-8
Molecular Weight (g/mol) 181.62
MDL Number MFCD00017147
SMILES NC(=O)\C=C\C1=CC=C(Cl)C=C1
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
IUPAC Name (E)-3-(4-chlorophenyl)prop-2-enamide
InChI Key PWXPFYVNYKVJBW-ZZXKWVIFSA-N
Molecular Formula C9H8ClNO