Benzyl mandelate

CAS Registry Number®

890-98-2

CAS Name

Benzyl mandelate

Molecular Formula

C15H14O3

Molecular Mass

242.27

Cite this Page

Benzyl mandelate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=890-98-2 (retrieved 2024-11-22) (CAS RN: 890-98-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    93 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C15H14O3/c16-14(13-9-5-2-6-10-13)15(17)18-11-12-7-3-1-4-8-12/h1-10,14,16H,11H2

InChIKey

InChIKey=JFKWZVQEMSKSBU-UHFFFAOYSA-N

SMILES

C(C(OCC1=CC=CC=C1)=O)(O)C2=CC=CC=C2

Canonical SMILES

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

Other Names for this Substance

  • Benzeneacetic acid, α-hydroxy-, phenylmethyl ester
  • Mandelic acid, benzyl ester
  • Benzyl mandelate
  • Phenylglycolic acid benzyl ester
  • Benzylin

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Deleted or Replaced CAS Registry Numbers

80409-16-1

CAS INSIGHTSTM
Targeted protein degrader structure, illustration