4-(1H-Pyrazol-1-yl)-2-butanone

CAS Registry Number®

89943-03-3
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CAS Name

4-(1H-Pyrazol-1-yl)-2-butanone

Molecular Formula

C7H10N2O

Molecular Mass

138.17

Cite this Page

4-(1H-Pyrazol-1-yl)-2-butanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=89943-03-3 (retrieved 2024-07-08) (CAS RN: 89943-03-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    109 °C @ Press: 11 Torr

  • Melting Point (2)

    79 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H10N2O/c1-7(10)3-6-9-5-2-4-8-9/h2,4-5H,3,6H2,1H3

InChIKey

InChIKey=YGSSCNXKGBWTBR-UHFFFAOYSA-N

SMILES

C(CC(C)=O)N1C=CC=N1

Canonical SMILES

O=C(C)CCN1N=CC=C1

Other Names for this Substance

  • 2-Butanone, 4-(1H-pyrazol-1-yl)-
  • 2-Butanone, 4-pyrazol-1-yl-
  • 4-(1H-Pyrazol-1-yl)-2-butanone