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Phenylpropanoic acids

Organic compounds consisting of a carboxylic acid with the formula: C9H10O2; also known as hydrocinnamic acid. They are widely used in cosmetics, as food additives, and in the pharmaceutical industry.
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1 – 15 of 209 results
1

3-(3,4,5-Trimethoxyphenyl)propionic acid, 98%

CAS: 25173-72-2 Molecular Formula: C12H16O5 Molecular Weight (g/mol): 240.25 InChI Key: ZCYXGVJUZBKJAI-UHFFFAOYSA-N Synonym: 3-3,4,5-trimethoxyphenyl propanoic acid,3-3,4,5-trimethoxyphenyl propionic acid,benzenepropanoic acid, 3,4,5-trimethoxy,3,4,5-trimethoxyhydrocinnamic acid,3,4,5-trimethoxydihydrocinnamic acid,3,4,5-trimethoxyphenylpropionic acid,3,4,5-trimethoxybenzenepropanoic acid,3,4,5-trimethoxy-benzenepropanoic acid,acmc-1cazt,maybridge1_005958 PubChem CID: 64860 ChEBI: CHEBI:583580 IUPAC Name: 3-(3,4,5-trimethoxyphenyl)propanoic acid SMILES: COC1=CC(=CC(=C1OC)OC)CCC(=O)O

PubChem CID 64860
CAS 25173-72-2
Molecular Weight (g/mol) 240.25
ChEBI CHEBI:583580
SMILES COC1=CC(=CC(=C1OC)OC)CCC(=O)O
Synonym 3-3,4,5-trimethoxyphenyl propanoic acid,3-3,4,5-trimethoxyphenyl propionic acid,benzenepropanoic acid, 3,4,5-trimethoxy,3,4,5-trimethoxyhydrocinnamic acid,3,4,5-trimethoxydihydrocinnamic acid,3,4,5-trimethoxyphenylpropionic acid,3,4,5-trimethoxybenzenepropanoic acid,3,4,5-trimethoxy-benzenepropanoic acid,acmc-1cazt,maybridge1_005958
IUPAC Name 3-(3,4,5-trimethoxyphenyl)propanoic acid
InChI Key ZCYXGVJUZBKJAI-UHFFFAOYSA-N
Molecular Formula C12H16O5
2

Ibuprofen, USP, 97-103%, Spectrum™ Chemical
SDP

CAS: 15687-27-1 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.29 MDL Number: MFCD00010393 InChI Key: HEFNNWSXXWATRW-UHFFFAOYNA-N IUPAC Name: 2-[4-(2-methylpropyl)phenyl]propanoic acid SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(O)=O

CAS 15687-27-1
Molecular Weight (g/mol) 206.29
MDL Number MFCD00010393
SMILES CC(C)CC1=CC=C(C=C1)C(C)C(O)=O
IUPAC Name 2-[4-(2-methylpropyl)phenyl]propanoic acid
InChI Key HEFNNWSXXWATRW-UHFFFAOYNA-N
Molecular Formula C13H18O2
3

L(-)-3-Phenyllactic acid, 98%

CAS: 20312-36-1 Molecular Formula: C9H9O3 Molecular Weight (g/mol): 165.17 MDL Number: MFCD00004244 InChI Key: VOXXWSYKYCBWHO-QMMMGPOBSA-M Synonym: l---3-phenyllactic acid,s-2-hydroxy-3-phenylpropionic acid,s-2-hydroxy-3-phenylpropanoic acid,l--3-phenyllactic acid,s---3-phenyllactic acid,l-3-phenyllactic acid,d-3-phenyllactic acid,2s-2-hydroxy-3-phenylpropanoic acid,s-3-phenyllactic acid,s---2-hydroxy-3-phenylpropionic acid PubChem CID: 444718 ChEBI: CHEBI:43065 IUPAC Name: (2S)-2-hydroxy-3-phenylpropanoic acid SMILES: O[C@@H](CC1=CC=CC=C1)C([O-])=O

EDGE
PubChem CID 444718
CAS 20312-36-1
Molecular Weight (g/mol) 165.17
ChEBI CHEBI:43065
MDL Number MFCD00004244
SMILES O[C@@H](CC1=CC=CC=C1)C([O-])=O
Synonym l---3-phenyllactic acid,s-2-hydroxy-3-phenylpropionic acid,s-2-hydroxy-3-phenylpropanoic acid,l--3-phenyllactic acid,s---3-phenyllactic acid,l-3-phenyllactic acid,d-3-phenyllactic acid,2s-2-hydroxy-3-phenylpropanoic acid,s-3-phenyllactic acid,s---2-hydroxy-3-phenylpropionic acid
IUPAC Name (2S)-2-hydroxy-3-phenylpropanoic acid
InChI Key VOXXWSYKYCBWHO-QMMMGPOBSA-M
Molecular Formula C9H9O3
4

3-(4-Chlorosulfonylphenyl)propionic acid, 99%

CAS: 63545-54-0 Molecular Formula: C9H9ClO4S Molecular Weight (g/mol): 248.68 MDL Number: MFCD02179510 InChI Key: INJMPXHPNFJMLG-UHFFFAOYSA-N Synonym: 3-4-chlorosulfonyl phenyl propanoic acid,benzenepropanoicacid, 4-chlorosulfonyl,3-4-chlorosulphonyl phenyl propanoic acid,3-4-chlorosulfonylphenyl propionic acid,3-4-chlorosulfonylphenyl propanoic acid,p-chlorosylphonyldihydrocinnamic acid,4-chlorosulfonyl benzenepropanoic acid,4-chlorosulphonyl dihydrocinnamic acid,p-chlorosulphonyldihydrocinnamic acid PubChem CID: 2757915 IUPAC Name: 3-[4-(chlorosulfonyl)phenyl]propanoic acid SMILES: OC(=O)CCC1=CC=C(C=C1)S(Cl)(=O)=O

PubChem CID 2757915
CAS 63545-54-0
Molecular Weight (g/mol) 248.68
MDL Number MFCD02179510
SMILES OC(=O)CCC1=CC=C(C=C1)S(Cl)(=O)=O
Synonym 3-4-chlorosulfonyl phenyl propanoic acid,benzenepropanoicacid, 4-chlorosulfonyl,3-4-chlorosulphonyl phenyl propanoic acid,3-4-chlorosulfonylphenyl propionic acid,3-4-chlorosulfonylphenyl propanoic acid,p-chlorosylphonyldihydrocinnamic acid,4-chlorosulfonyl benzenepropanoic acid,4-chlorosulphonyl dihydrocinnamic acid,p-chlorosulphonyldihydrocinnamic acid
IUPAC Name 3-[4-(chlorosulfonyl)phenyl]propanoic acid
InChI Key INJMPXHPNFJMLG-UHFFFAOYSA-N
Molecular Formula C9H9ClO4S
5

3-[4-(Methylthio)phenyl]propionic acid, 96%

CAS: 138485-81-1 Molecular Formula: C10H12O2S Molecular Weight (g/mol): 196.264 MDL Number: MFCD03425696 InChI Key: ASTVFRXZLBGVRL-UHFFFAOYSA-N PubChem CID: 3801098 IUPAC Name: 3-(4-methylsulfanylphenyl)propanoic acid SMILES: CSC1=CC=C(C=C1)CCC(=O)O

PubChem CID 3801098
CAS 138485-81-1
Molecular Weight (g/mol) 196.264
MDL Number MFCD03425696
SMILES CSC1=CC=C(C=C1)CCC(=O)O
IUPAC Name 3-(4-methylsulfanylphenyl)propanoic acid
InChI Key ASTVFRXZLBGVRL-UHFFFAOYSA-N
Molecular Formula C10H12O2S
6

3-(Boc-amino)-3-phenylpropionic acid, 97%

CAS: 14676-01-8 Molecular Formula: C14H19NO4 Molecular Weight (g/mol): 265.309 MDL Number: MFCD02090695 InChI Key: JTNQFJPZRTURSI-UHFFFAOYSA-N Synonym: 3-boc-amino-3-phenylpropionic acid,3-n-boc-3-phenylpropionic acid,boc-dl-beta-phe-oh,3-tert-butoxycarbonyl amino-3-phenylpropanoic acid,3-boc-amino-3-phenyl-propionic acid,3-tert-butoxycarbonylamino-3-phenylpropanoic acid,3-tert-butoxy carbonyl amino-3-phenylpropanoic acid,boc-d-,a-phe-oh,pubchem16181 PubChem CID: 2756815 IUPAC Name: 3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoic acid SMILES: CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC=CC=C1

PubChem CID 2756815
CAS 14676-01-8
Molecular Weight (g/mol) 265.309
MDL Number MFCD02090695
SMILES CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC=CC=C1
Synonym 3-boc-amino-3-phenylpropionic acid,3-n-boc-3-phenylpropionic acid,boc-dl-beta-phe-oh,3-tert-butoxycarbonyl amino-3-phenylpropanoic acid,3-boc-amino-3-phenyl-propionic acid,3-tert-butoxycarbonylamino-3-phenylpropanoic acid,3-tert-butoxy carbonyl amino-3-phenylpropanoic acid,boc-d-,a-phe-oh,pubchem16181
IUPAC Name 3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoic acid
InChI Key JTNQFJPZRTURSI-UHFFFAOYSA-N
Molecular Formula C14H19NO4
7

DL-2-Phenylpropionic acid, 98%

CAS: 492-37-5 MDL Number: MFCD00002650 InChI Key: YPGCWEMNNLXISK-UHFFFAOYSA-N Synonym: 2-phenylpropionic acid,hydratropic acid,dl-2-phenylpropionic acid,alpha-methylphenylacetic acid,2-phenyl-propionic acid,+/--2-phenylpropionic acid,alpha-methylbenzeneacetic acid,benzeneacetic acid, .alpha.-methyl,hydratropasaeure,alpha-phenylpropionic acid PubChem CID: 10296 ChEBI: CHEBI:48526 IUPAC Name: 2-phenylpropanoic acid SMILES: CC(C1=CC=CC=C1)C(=O)O

PubChem CID 10296
CAS 492-37-5
ChEBI CHEBI:48526
MDL Number MFCD00002650
SMILES CC(C1=CC=CC=C1)C(=O)O
Synonym 2-phenylpropionic acid,hydratropic acid,dl-2-phenylpropionic acid,alpha-methylphenylacetic acid,2-phenyl-propionic acid,+/--2-phenylpropionic acid,alpha-methylbenzeneacetic acid,benzeneacetic acid, .alpha.-methyl,hydratropasaeure,alpha-phenylpropionic acid
IUPAC Name 2-phenylpropanoic acid
InChI Key YPGCWEMNNLXISK-UHFFFAOYSA-N
8

2-[4-(Bromomethyl)phenyl]propionic acid, 96%

CAS: 111128-12-2 Molecular Formula: C10H11BrO2 Molecular Weight (g/mol): 243.1 MDL Number: MFCD02093445 InChI Key: QQXBRVQJMKBAOZ-UHFFFAOYSA-N Synonym: 2-4-bromomethyl phenyl propanoic acid,2-4-bromomethyl phenyl propionic acid,2-4-bromomethyl phenylpropionic acid,2-4-bromomethyl-phenyl-propionic acid,4-bromomethyl hydratropic acid,2-4-bromomethyl phenyl propanic acid,2-p-bromomethyl phenyl propionic acid,2-4'-bromomethylphenyl propionic acid,2-4-bromomethyl phenylproplonic acid PubChem CID: 2733978 IUPAC Name: 2-[4-(bromomethyl)phenyl]propanoic acid SMILES: CC(C1=CC=C(C=C1)CBr)C(=O)O

PubChem CID 2733978
CAS 111128-12-2
Molecular Weight (g/mol) 243.1
MDL Number MFCD02093445
SMILES CC(C1=CC=C(C=C1)CBr)C(=O)O
Synonym 2-4-bromomethyl phenyl propanoic acid,2-4-bromomethyl phenyl propionic acid,2-4-bromomethyl phenylpropionic acid,2-4-bromomethyl-phenyl-propionic acid,4-bromomethyl hydratropic acid,2-4-bromomethyl phenyl propanic acid,2-p-bromomethyl phenyl propionic acid,2-4'-bromomethylphenyl propionic acid,2-4-bromomethyl phenylproplonic acid
IUPAC Name 2-[4-(bromomethyl)phenyl]propanoic acid
InChI Key QQXBRVQJMKBAOZ-UHFFFAOYSA-N
Molecular Formula C10H11BrO2
9

3-(2,6-Dichlorophenyl)propionic acid, 96%

CAS: 51656-68-9 Molecular Formula: C9H8Cl2O2 Molecular Weight (g/mol): 219.061 MDL Number: MFCD01310807 InChI Key: IDEOVPXKPDUXTP-UHFFFAOYSA-N PubChem CID: 2758192 IUPAC Name: 3-(2,6-dichlorophenyl)propanoic acid SMILES: C1=CC(=C(C(=C1)Cl)CCC(=O)O)Cl

PubChem CID 2758192
CAS 51656-68-9
Molecular Weight (g/mol) 219.061
MDL Number MFCD01310807
SMILES C1=CC(=C(C(=C1)Cl)CCC(=O)O)Cl
IUPAC Name 3-(2,6-dichlorophenyl)propanoic acid
InChI Key IDEOVPXKPDUXTP-UHFFFAOYSA-N
Molecular Formula C9H8Cl2O2
10

3-[3-(Benzyloxy)phenyl]propionic acid, 96%

CAS: 57668-34-5 Molecular Formula: C16H16O3 Molecular Weight (g/mol): 256.301 MDL Number: MFCD09258905 InChI Key: HVXOYUOKPLHWNU-UHFFFAOYSA-N Synonym: 3-3-benzyloxy phenyl propanoic acid,benzenepropanoic acid, 3-phenylmethoxy,3-3-benzyloxy-phenyl-propanoic acid,3-3-benzyloxy phenyl propionic acid,3-3-phenylmethyl oxy phenyl propanoic acid PubChem CID: 21938504 IUPAC Name: 3-(3-phenylmethoxyphenyl)propanoic acid SMILES: C1=CC=C(C=C1)COC2=CC=CC(=C2)CCC(=O)O

PubChem CID 21938504
CAS 57668-34-5
Molecular Weight (g/mol) 256.301
MDL Number MFCD09258905
SMILES C1=CC=C(C=C1)COC2=CC=CC(=C2)CCC(=O)O
Synonym 3-3-benzyloxy phenyl propanoic acid,benzenepropanoic acid, 3-phenylmethoxy,3-3-benzyloxy-phenyl-propanoic acid,3-3-benzyloxy phenyl propionic acid,3-3-phenylmethyl oxy phenyl propanoic acid
IUPAC Name 3-(3-phenylmethoxyphenyl)propanoic acid
InChI Key HVXOYUOKPLHWNU-UHFFFAOYSA-N
Molecular Formula C16H16O3
11

3-(2,5-Dimethoxyphenyl)propionic acid, 96%

CAS: 10538-49-5 Molecular Formula: C11H14O4 Molecular Weight (g/mol): 210.23 MDL Number: MFCD00060325 InChI Key: JENQUCZZZGYHRW-UHFFFAOYSA-N PubChem CID: 66343 IUPAC Name: 3-(2,5-dimethoxyphenyl)propanoic acid SMILES: COC1=CC=C(OC)C(CCC(O)=O)=C1

PubChem CID 66343
CAS 10538-49-5
Molecular Weight (g/mol) 210.23
MDL Number MFCD00060325
SMILES COC1=CC=C(OC)C(CCC(O)=O)=C1
IUPAC Name 3-(2,5-dimethoxyphenyl)propanoic acid
InChI Key JENQUCZZZGYHRW-UHFFFAOYSA-N
Molecular Formula C11H14O4
12

3-(4-n-Propoxyphenyl)propionic acid, 96%

CAS: 3243-40-1 Molecular Formula: C12H16O3 Molecular Weight (g/mol): 208.257 MDL Number: MFCD00484121 InChI Key: SOFMLHAGBATXNZ-UHFFFAOYSA-N Synonym: 3-4-propoxyphenyl propanoic acid,3-4-propoxy-phenyl-propionic acid,benzenepropanoic acid,4-propoxy,3-4-n-propoxyphenyl propionic acid,cbmicro_011397,cambridge id 5152838,4-propoxy-benzenepropanoic acid,3-4-n-propoxyphenyl propanoic acid PubChem CID: 2255935 IUPAC Name: 3-(4-propoxyphenyl)propanoic acid SMILES: CCCOC1=CC=C(C=C1)CCC(=O)O

PubChem CID 2255935
CAS 3243-40-1
Molecular Weight (g/mol) 208.257
MDL Number MFCD00484121
SMILES CCCOC1=CC=C(C=C1)CCC(=O)O
Synonym 3-4-propoxyphenyl propanoic acid,3-4-propoxy-phenyl-propionic acid,benzenepropanoic acid,4-propoxy,3-4-n-propoxyphenyl propionic acid,cbmicro_011397,cambridge id 5152838,4-propoxy-benzenepropanoic acid,3-4-n-propoxyphenyl propanoic acid
IUPAC Name 3-(4-propoxyphenyl)propanoic acid
InChI Key SOFMLHAGBATXNZ-UHFFFAOYSA-N
Molecular Formula C12H16O3
13

(R)-3-(Boc-amino)-3-(4-bromophenyl)propionic acid, 95%

CAS: 261380-20-5 Molecular Formula: C14H18BrNO4 Molecular Weight (g/mol): 344.205 MDL Number: MFCD01320860 InChI Key: ZAMLGGRVTAXBHI-LLVKDONJSA-N Synonym: boc-r-3-amino-3-4-bromo-phenyl-propionic acid,r-3-4-bromophenyl-3-tert-butoxycarbonyl amino propanoic acid,r-boc-4-bromo-beta-phe-oh,boc-4-bromo-l-beta-phenylalanine,boc-beta-r-4-bromophenylalanine,r-n-boc-3-amino-3-4-bromophenyl propanoic acid,boc-r-4-beta-bromophenylalanine,r-3-boc-amino-3-4-bromophenyl propionic acid,boc-r-4-bromo-beta-phenylalanine,r-n-boc-beta-4-bromophenyl-beta-alanine PubChem CID: 7009110 IUPAC Name: (3R)-3-(4-bromophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid SMILES: CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC=C(C=C1)Br

PubChem CID 7009110
CAS 261380-20-5
Molecular Weight (g/mol) 344.205
MDL Number MFCD01320860
SMILES CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC=C(C=C1)Br
Synonym boc-r-3-amino-3-4-bromo-phenyl-propionic acid,r-3-4-bromophenyl-3-tert-butoxycarbonyl amino propanoic acid,r-boc-4-bromo-beta-phe-oh,boc-4-bromo-l-beta-phenylalanine,boc-beta-r-4-bromophenylalanine,r-n-boc-3-amino-3-4-bromophenyl propanoic acid,boc-r-4-beta-bromophenylalanine,r-3-boc-amino-3-4-bromophenyl propionic acid,boc-r-4-bromo-beta-phenylalanine,r-n-boc-beta-4-bromophenyl-beta-alanine
IUPAC Name (3R)-3-(4-bromophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI Key ZAMLGGRVTAXBHI-LLVKDONJSA-N
Molecular Formula C14H18BrNO4
14

3-(5-Bromo-2-methoxyphenyl)propionic acid, 96%, Thermo Scientific Chemicals

CAS: 82547-30-6 Molecular Formula: C10H11BrO3 Molecular Weight (g/mol): 259.10 MDL Number: MFCD09258907 InChI Key: RCLIOLQUIYTUPY-UHFFFAOYSA-N Synonym: 3-5-bromo-2-methoxyphenyl propanoic acid,benzenepropanoic acid, 5-bromo-2-methoxy,3-5-bromo-2-methoxyphenyl propionic acid,3-5-bromo-2-methoxy-phenyl-propionic acid PubChem CID: 22685184 IUPAC Name: 3-(5-bromo-2-methoxyphenyl)propanoic acid SMILES: COC1=C(CCC(O)=O)C=C(Br)C=C1

PubChem CID 22685184
CAS 82547-30-6
Molecular Weight (g/mol) 259.10
MDL Number MFCD09258907
SMILES COC1=C(CCC(O)=O)C=C(Br)C=C1
Synonym 3-5-bromo-2-methoxyphenyl propanoic acid,benzenepropanoic acid, 5-bromo-2-methoxy,3-5-bromo-2-methoxyphenyl propionic acid,3-5-bromo-2-methoxy-phenyl-propionic acid
IUPAC Name 3-(5-bromo-2-methoxyphenyl)propanoic acid
InChI Key RCLIOLQUIYTUPY-UHFFFAOYSA-N
Molecular Formula C10H11BrO3
15

3-(4-Chloro-3-methylphenyl)propionic acid, 96%

CAS: 1086386-05-1 Molecular Formula: C10H11ClO2 Molecular Weight (g/mol): 198.646 MDL Number: MFCD11655590 InChI Key: PCLIPGMIRVJYFB-UHFFFAOYSA-N Synonym: 3-4-chloro-3-methylphenyl propanoic acid,3-4-chloro-3-methyl-phenyl-propionic acid,3-4-chloro-3-methylphenyl propionic acid,benzenepropanoic acid, 4-chloro-3-methyl PubChem CID: 46741400 IUPAC Name: 3-(4-chloro-3-methylphenyl)propanoic acid SMILES: CC1=C(C=CC(=C1)CCC(=O)O)Cl

PubChem CID 46741400
CAS 1086386-05-1
Molecular Weight (g/mol) 198.646
MDL Number MFCD11655590
SMILES CC1=C(C=CC(=C1)CCC(=O)O)Cl
Synonym 3-4-chloro-3-methylphenyl propanoic acid,3-4-chloro-3-methyl-phenyl-propionic acid,3-4-chloro-3-methylphenyl propionic acid,benzenepropanoic acid, 4-chloro-3-methyl
IUPAC Name 3-(4-chloro-3-methylphenyl)propanoic acid
InChI Key PCLIPGMIRVJYFB-UHFFFAOYSA-N
Molecular Formula C10H11ClO2