chempirical

Benzyl phenylacetate

C15H14O2CAS 102-16-9226.27 g/mol

Open in Covalent MOL file
OO
Ester

Properties

Molecular formula
C15H14O2
Molar mass
226.27 g/mol
Exact mass
226.0994 Da
Melting point
51–52 °C
Boiling point
175–176 °C (at 12 Torr)
logP
2.97Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
4

Identifiers

CAS number
102-16-9
SMILES
O=C(Cc1ccccc1)OCc1ccccc1
InChIKey
MIYFJEKZLFWKLZ-UHFFFAOYSA-N
InChI
InChI=1S/C15H14O2/c16-15(11-13-7-3-1-4-8-13)17-12-14-9-5-2-6-10-14/h1-10H,11-12H2

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Names and synonyms

5 names
  • Benzeneacetic acid, phenylmethyl ester
  • Acetic acid, phenyl-, benzyl ester
  • Benzyl α-toluate
  • Benzyl benzeneacetate
  • Benzyl 2-phenylacetate

Work with Benzyl phenylacetate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

2-Methyl 4-benzyloxybenzaldehyde101093-56-5 P-Cresyl phenylacetate101-94-0 4'-Methoxy-2-phenylacetophenone1023-17-2 Methyl 4′-methylbiphenyl-2-carboxylate114772-34-8 1-[3-(Phenylmethoxy)phenyl]ethanone34068-01-4 Methyl α-phenylbenzeneacetate3469-00-9 2′-Hydroxydihydrochalcone3516-95-8 (±)-Benzoin methyl ether3524-62-7

Elsewhere

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