C1=CC(=CC=C1CCC(=O)O)O
CAS: 501-97-3
Name: 3-(4-hydroxyphenyl)propanoic acid
SMILES: C1=CC(=CC=C1CCC(=O)O)O

Molecular Processing

Molecular formula
C9H10O3
Molecular weight
166.18
Exact mass
166.063
XLogP
1.41
TPSA
57.53
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
44.06

Supplementary Information

InChIKey: NMHMNPHRMNGLLB-UHFFFAOYSA-N
Synonyme
3-(4-Hydroxyphenyl)propionic acid501-97-3Phloretic acid3-(4-Hydroxyphenyl)propanoic acidHydro-p-coumaric acidDihydro-p-coumaric acidBenzenepropanoic acid, 4-hydroxy-4-Hydroxyphenylpropionic acidp-Hydroxyhydrocinnamic acid3-(p-Hydroxyphenyl)propionic acid4-Hydroxybenzenepropanoic acidp-Hydroxyphenylpropionic acidHydrocinnamic acid, p-hydroxy-Phloretinic acidbeta-(p-Hydroxyphenyl)propionic acid4-HYDROXYHYDROCINNAMIC ACID6QNC6P18SRDTXSID2075427NSC-40949CHEBI:32980RefChem:861868DTXCID2040781207-931-3desaminotyrosineHYDROXYPHENYL PROPIONIC ACIDMFCD000027783-(4'-Hydroxyphenyl)propionic acidNSC 40949Dihydrocoumaric acid4-hydroxy-benzenepropanoic acid
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