Methyl 4-bromo-3,5-dimethyl-1H-pyrazole-1-propanoate

CAS Registry Number®

1001500-73-7
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CAS Name

Methyl 4-bromo-3,5-dimethyl-1H-pyrazole-1-propanoate

Molecular Formula

C9H13BrN2O2

Molecular Mass

261.12

Cite this Page

Methyl 4-bromo-3,5-dimethyl-1H-pyrazole-1-propanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1001500-73-7 (retrieved 2024-09-06) (CAS RN: 1001500-73-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    117-119 °C @ Press: 1 mmHg

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H13BrN2O2/c1-6-9(10)7(2)12(11-6)5-4-8(13)14-3/h4-5H2,1-3H3

InChIKey

InChIKey=ATDKDNJRUBWAGH-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(OC)CCN1N=C(C(Br)=C1C)C

Other Names for this Substance

  • 1H-Pyrazole-1-propanoic acid, 4-bromo-3,5-dimethyl-, methyl ester
  • Methyl 4-bromo-3,5-dimethyl-1H-pyrazole-1-propanoate