Benzoic acid, 5-bromo-2-(phenylmethoxy)-, phenylmethyl ester

CAS Registry Number®

850350-09-3
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CAS Name

Benzoic acid, 5-bromo-2-(phenylmethoxy)-, phenylmethyl ester

Molecular Formula

C21H17BrO3

Molecular Mass

397.26

Cite this Page

Benzoic acid, 5-bromo-2-(phenylmethoxy)-, phenylmethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=850350-09-3 (retrieved 2024-09-07) (CAS RN: 850350-09-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H17BrO3/c22-18-11-12-20(24-14-16-7-3-1-4-8-16)19(13-18)21(23)25-15-17-9-5-2-6-10-17/h1-13H,14-15H2

InChIKey

InChIKey=NXHFWYNZSJELII-UHFFFAOYSA-N

SMILES

C(OCC1=CC=CC=C1)(=O)C2=C(OCC3=CC=CC=C3)C=CC(Br)=C2

Canonical SMILES

O=C(OCC=1C=CC=CC1)C2=CC(Br)=CC=C2OCC=3C=CC=CC3

Other Names for this Substance

  • Benzoic acid, 5-bromo-2-(phenylmethoxy)-, phenylmethyl ester
  • Phenylmethyl 5-bromo-2-(phenylmethoxy)benzoate
  • Benzyl 2-(benzyloxy)-5-bromobenzoate
  • 2-Benzyloxy-5-bromo-benzoic acid benzyl ester