Benzoximate

CAS Registry Number®

29104-30-1

CAS Name

Benzoximate

Molecular Formula

C18H18ClNO5

Molecular Mass

363.79

Cite this Page

Benzoximate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=29104-30-1 (retrieved 2024-11-22) (CAS RN: 29104-30-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    73 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C18H18ClNO5/c1-4-24-20-17(25-18(21)12-8-6-5-7-9-12)15-14(22-2)11-10-13(19)16(15)23-3/h5-11H,4H2,1-3H3

InChIKey

InChIKey=BZMIHNKNQJJVRO-UHFFFAOYSA-N

SMILES

C(OC(=O)C1=CC=CC=C1)(=NOCC)C2=C(OC)C(Cl)=CC=C2OC

Canonical SMILES

O=C(OC(=NOCC)C=1C(OC)=CC=C(Cl)C1OC)C=2C=CC=CC2

Other Names for this Substance

  • Benzoic acid, anhydride with 3-chloro-N-ethoxy-2,6-dimethoxybenzenecarboximidic acid
  • Benzoic acid, anhydride with 3-chloro-N-ethoxy-2,6-dimethoxybenzimidic acid
  • Benzimidic acid, 3-chloro-N-ethoxy-2,6-dimethoxy-, anhydride with benzoic acid
  • Ethyl O-benzoyl-3-chloro-2,6-dimethoxybenzohydroxamate
  • Benzomate

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