Ethyl β-oxo-α-(phenylmethyl)benzenepropanoate

CAS Registry Number®

56409-75-7

CAS Name

Ethyl β-oxo-α-(phenylmethyl)benzenepropanoate

Molecular Formula

C18H18O3

Molecular Mass

282.33

Cite this Page

Ethyl β-oxo-α-(phenylmethyl)benzenepropanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=56409-75-7 (retrieved 2024-11-25) (CAS RN: 56409-75-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    218-220 °C @ Press: 12 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H18O3/c1-2-21-18(20)16(13-14-9-5-3-6-10-14)17(19)15-11-7-4-8-12-15/h3-12,16H,2,13H2,1H3

InChIKey

InChIKey=KSTSKHKQRFGSJH-UHFFFAOYSA-N

SMILES

C(C(=O)C1=CC=CC=C1)(CC2=CC=CC=C2)C(OCC)=O

Canonical SMILES

O=C(OCC)C(C(=O)C=1C=CC=CC1)CC=2C=CC=CC2

Other Names for this Substance

  • Benzenepropanoic acid, β-oxo-α-(phenylmethyl)-, ethyl ester
  • Ethyl β-oxo-α-(phenylmethyl)benzenepropanoate
  • NSC 101558
  • Ethyl 2-benzyl-3-oxo-3-phenylpropanoate

CAS INSIGHTSTM
Hourglass and a clock