Isopropyl phenylacetate

CAS Registry Number®

4861-85-2

CAS Name

Isopropyl phenylacetate

Molecular Formula

C11H14O2

Molecular Mass

178.23

Cite this Page

Isopropyl phenylacetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4861-85-2 (retrieved 2024-11-21) (CAS RN: 4861-85-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    224 °C @ Press: 760 Torr

  • Melting Point (2)

    25-27 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H14O2/c1-9(2)13-11(12)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3

InChIKey

InChIKey=SSMBXPJYHMZLOJ-UHFFFAOYSA-N

SMILES

C(C(OC(C)C)=O)C1=CC=CC=C1

Canonical SMILES

O=C(OC(C)C)CC=1C=CC=CC1

Other Names for this Substance

  • Benzeneacetic acid, 1-methylethyl ester
  • Acetic acid, phenyl-, isopropyl ester
  • Isopropyl phenylacetate
  • Isopropyl benzeneacetate
  • 1-Methylethyl 2-phenylethanoate

CAS INSIGHTSTM
Targeted protein degrader structure, illustration