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Substance Name: 4-Bromo-3-methyl-1H-pyrazole
RN: 13808-64-5
InChIKey: IXQPRETWBGVNPJ-UHFFFAOYSA-N

Molecular Formula

  • C4-H5-Br-N2

Molecular Weight

  • 161.001
 
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Names and Synonyms

Synonym

  • EINECS 237-456-7

Systematic Name

  • 4-Bromo-3-methyl-1H-pyrazole

Registry Numbers

CAS Registry Number

  • 13808-64-5

System Generated Number

  • 0013808645

Structure Descriptors

InChI

1S/C4H5BrN2/c1-3-4(5)2-6-7-3/h2H,1H3,(H,6,7)

InChIKey

IXQPRETWBGVNPJ-UHFFFAOYSA-N

Smiles

c1(c(n[nH]c1)C)Br

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 76.5 deg C   EXP
log P (octanol-water) 1.500 (none)   EST
Atmospheric OH Rate Constant 2.79E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.