Ethyl (R)-2-hydroxy-4-phenylbutyrate

C12H16O3CAS 90315-82-5208.26 g/mol

OOHO
AlcoholEster

Properties

Molecular formula
C12H16O3
Molar mass
208.26 g/mol
Exact mass
208.1099 Da
Boiling point
120 °C (at 1 Torr)
logP
1.54Crippen estimate
Polar surface area
46.5 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
5
Stereocentres
Rin SMILES atom order

Identifiers

CAS number
90315-82-5
SMILES
CCOC(=O)[C@H](O)CCc1ccccc1
InChIKey
ZJYKSSGYDPNKQS-LLVKDONJSA-N
InChI
InChI=1S/C12H16O3/c1-2-15-12(14)11(13)9-8-10-6-4-3-5-7-10/h3-7,11,13H,2,8-9H2,1H3/t11-/m1/s1

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Type any one amount. The others follow from the molar mass.

Names and synonyms

12 names
  • Benzenebutanoic acid, α-hydroxy-, ethyl ester, (αR)-
  • Benzenebutanoic acid, α-hydroxy-, ethyl ester, (R)-
  • Ethyl (R)-2-hydroxy-4-phenylbutanoate
  • Ethyl (R)-4-phenyl-2-hydroxybutyrate
  • Ethyl 2(R)-hydroxy-4-phenylbutyrate
  • (R)-2-Hydroxy-4-phenylbutanoic acid ethyl ester
  • (R)-Ethyl 4-phenyl-2-hydroxybutanoate
  • Ethyl (2R)-2-hydroxy-4-phenylbutyrate
  • (αR)-α-Hydroxybenzenebutanoic acid ethyl ester
  • (R)-Ethyl 2-hydroxy-4-phenylbutanoic acid
  • (R)-4-Phenyl-2-hydroxybutanoic acid ethyl ester
  • (R)-Ethyl2-hydroxy-4-phenylbutanoate

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Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

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