O-Acetylmandelic acid

CAS Registry Number®

5438-68-6
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CAS Name

O-Acetylmandelic acid

Molecular Formula

C10H10O4

Molecular Mass

194.18

Cite this Page

O-Acetylmandelic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=5438-68-6 (retrieved 2024-04-29) (CAS RN: 5438-68-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H10O4/c1-7(11)14-9(10(12)13)8-5-3-2-4-6-8/h2-6,9H,1H3,(H,12,13)

InChIKey

InChIKey=OBCUSTCTKLTMBX-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzeneacetic acid, α-(acetyloxy)-
  • Mandelic acid, acetate
  • α-(Acetyloxy)benzeneacetic acid
  • O-Acetylmandelic acid
  • Acetoxyphenylacetic acid

Deleted or Replaced CAS Registry Numbers

29071-09-8

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