α-[(Acetyloxy)methyl]benzenepropanoic acid

CAS Registry Number®

187610-68-0
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CAS Name

α-[(Acetyloxy)methyl]benzenepropanoic acid

Molecular Formula

C12H14O4

Molecular Mass

222.24

Cite this Page

α-[(Acetyloxy)methyl]benzenepropanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=187610-68-0 (retrieved 2024-09-08) (CAS RN: 187610-68-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H14O4/c1-9(13)16-8-11(12(14)15)7-10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3,(H,14,15)

InChIKey

InChIKey=XMLOIFZEDYSEGK-UHFFFAOYSA-N

SMILES

C(CC1=CC=CC=C1)(COC(C)=O)C(O)=O

Canonical SMILES

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

Other Names for this Substance

  • Benzenepropanoic acid, α-[(acetyloxy)methyl]-
  • α-[(Acetyloxy)methyl]benzenepropanoic acid
  • 2-Acetoxymethyl-3-phenylpropionic acid
  • 3-Acetoxy-2-benzylpropanoic acid

Deleted or Replaced CAS Registry Numbers

139756-86-8