(R)-2-Hydroxy-4-phenylbutyric acid
Properties
- Molecular formula
- C10H12O3
- Molar mass
- 180.20 g/mol
- Exact mass
- 180.0786 Da
- Melting point
- 115–117 °C
- logP
- 1.06Crippen estimate
- Polar surface area
- 57.5 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 4
- Stereocentres
- Rin SMILES atom order
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
29678-81-7SMILES
O=C(O)[C@H](O)CCc1ccccc1InChIKey
JNJCEALGCZSIGB-SECBINFHSA-NInChI
InChI=1S/C10H12O3/c11-9(10(12)13)7-6-8-4-2-1-3-5-8/h1-5,9,11H,6-7H2,(H,12,13)/t9-/m1/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
9 names
- Benzenebutanoic acid, α-hydroxy-, (αR)-
- Butyric acid, 2-hydroxy-4-phenyl-, D-(-)-
- Benzenebutanoic acid, α-hydroxy-, (R)-
- (αR)-α-Hydroxybenzenebutanoic acid
- D-(-)-Benzyllactic acid
- (R)-2-Hydroxy-4-phenylbutanoic acid
- (R)-(-)-2-Hydroxy-4-phenylbutyric acid
- (2R)-2-Hydroxy-4-phenylbutanoic acid
- (r)-2-Hydroxy-4-phenylbutyricacid
Work with (R)-2-Hydroxy-4-phenylbutyric acid
Similar compounds
(-)-3-Phenyllactic acid20312-36-171 % similar
(+)-3-Phenyllactic acid7326-19-471 % similar
(+-)-3-Phenyllactic acid828-01-371 % similar
Dl-homophenylalanine1012-05-162 % similar
D-Homophenylalanine82795-51-562 % similar
L-Homophenylalanine943-73-762 % similar
(S)-2-Hydroxy-4-(((phenylmethoxy)carbonyl)amino)butyric acid40371-50-457 % similar
(S)-2-Amino-4-phenylbutanoic acid hydrochloride105382-09-057 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.