Isocarboxazid

CAS Registry Number®

59-63-2

CAS Name

Isocarboxazid

Molecular Formula

C12H13N3O2

Molecular Mass

231.25

Cite this Page

Isocarboxazid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=59-63-2 (retrieved 2024-11-21) (CAS RN: 59-63-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    105-106 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C12H13N3O2/c1-9-7-11(15-17-9)12(16)14-13-8-10-5-3-2-4-6-10/h2-7,13H,8H2,1H3,(H,14,16)

InChIKey

InChIKey=XKFPYPQQHFEXRZ-UHFFFAOYSA-N

SMILES

C(NNCC1=CC=CC=C1)(=O)C=2C=C(C)ON2

Canonical SMILES

O=C(NNCC=1C=CC=CC1)C2=NOC(=C2)C

Other Names for this Substance

  • 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(phenylmethyl)hydrazide
  • 3-Isoxazolecarboxylic acid, 5-methyl-, 2-benzylhydrazide
  • Ro 5-0831
  • N′-Benzyl N-methyl-5-isoxazolecarboxylhydrazide-3
  • 1-Benzyl-2-(5-methyl-3-isoxazolyl-carbonyl)hydrazine

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration