5-(3-Methylphenyl)-1,3,4-oxadiazol-2(3H)-one

CAS Registry Number®

119933-33-4
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CAS Name

5-(3-Methylphenyl)-1,3,4-oxadiazol-2(3H)-one

Molecular Formula

C9H8N2O2

Molecular Mass

176.17

Cite this Page

5-(3-Methylphenyl)-1,3,4-oxadiazol-2(3H)-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=119933-33-4 (retrieved 2024-08-21) (CAS RN: 119933-33-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    113-114 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C9H8N2O2/c1-6-3-2-4-7(5-6)8-10-11-9(12)13-8/h2-5H,1H3,(H,11,12)

InChIKey

InChIKey=XMCUHRQSGWGCCI-UHFFFAOYSA-N

SMILES

CC=1C=C(C=CC1)C2=NNC(=O)O2

Canonical SMILES

O=C1OC(=NN1)C=2C=CC=C(C2)C

Other Names for this Substance

  • 1,3,4-Oxadiazol-2(3H)-one, 5-(3-methylphenyl)-
  • 5-(3-Methylphenyl)-1,3,4-oxadiazol-2(3H)-one