3-(1,1-Dimethylethyl)-1H-pyrazole

CAS Registry Number®

15802-80-9
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CAS Name

3-(1,1-Dimethylethyl)-1H-pyrazole

Molecular Formula

C7H12N2

Molecular Mass

124.18

Cite this Page

3-(1,1-Dimethylethyl)-1H-pyrazole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=15802-80-9 (retrieved 2024-04-29) (CAS RN: 15802-80-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    127 °C @ Press: 0.15 Torr

  • Melting Point (1)

    53-54 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H12N2/c1-7(2,3)6-4-5-8-9-6/h4-5H,1-3H3,(H,8,9)

InChIKey

InChIKey=YIDCITOHTLPMMZ-UHFFFAOYSA-N

SMILES

C(C)(C)(C)C=1C=CNN1

Canonical SMILES

N=1NC=CC1C(C)(C)C

Other Names for this Substance

  • 1H-Pyrazole, 3-(1,1-dimethylethyl)-
  • Pyrazole, 3-tert-butyl-
  • 3-(1,1-Dimethylethyl)-1H-pyrazole
  • 3-tert-Butylpyrazole
  • 3-tert-Butyl-1H-pyrazole

Deleted or Replaced CAS Registry Numbers

141665-15-8, 196207-20-2, 286384-49-4, 1444611-32-8, 1801687-10-4

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