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1-Methylpyrazole

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1-Methylpyrazole Basic information

Product Name:
1-Methylpyrazole
Synonyms:
  • 1-METHYLPYRAZOLE
  • 1-METHYL-1H-PYRAZOLE
  • AKOS PAO-1140
  • N-METHYLPYRAZOLE
  • TRIS-1-PYRAZOLYLMETHANE
  • 1H-Pyrazole, 1-methyl-
  • methylpyrazole
  • Pyrazole, 1-methyl-
CAS:
930-36-9
MF:
C4H6N2
MW:
82.1
EINECS:
618-896-2
Product Categories:
  • Heterocyclic Building Blocks
  • Pyrazoles
  • Pyrazoles & Triazoles
  • Pyrazoles & Triazoles
  • Building Blocks
  • bc0001
Mol File:
930-36-9.mol
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1-Methylpyrazole Chemical Properties

Melting point:
36.5°C (estimate)
Boiling point:
127 °C
Density 
0.988 g/mL at 20 °C (lit.)
refractive index 
n20/D 1.477
Flash point:
35 °C
storage temp. 
Inert atmosphere,Room Temperature
Water Solubility 
Soluble in water
pka
2.25±0.10(Predicted)
form 
Liquid
color 
Clear colorless to light yellow
BRN 
105207
InChI
InChI=1S/C4H6N2/c1-6-4-2-3-5-6/h2-4H,1H3
InChIKey
UQFQONCQIQEYPJ-UHFFFAOYSA-N
SMILES
N1(C)C=CC=N1
CAS DataBase Reference
930-36-9(CAS DataBase Reference)
NIST Chemistry Reference
1-methylpyrazole(930-36-9)
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Safety Information

Hazard Codes 
Xi
Risk Statements 
10-36/37/38
Safety Statements 
26-37/39-16
RIDADR 
UN 1993 3/PG 3
WGK Germany 
3
10
HazardClass 
3
PackingGroup 
III
HS Code 
29331990

MSDS

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1-Methylpyrazole Usage And Synthesis

Chemical Properties

clear colorless to light yellow liquid

Uses

1-Methylpyrazole is a useful synthetic intermediate. It is used to synthesize heteroaryl(fluorophenyl)piperidinylindoles as α1 adrenoceptor antagonists. It is also used to prepare quinazoline derivatives as glucokinase activators.

Definition

ChEBI: A member of the class of pyrazoles that is the 1-methyl derivative of 1H-pyrazole.

Synthesis

1-Methylpyrazole was prepared by the condensation of 1,1,3,3-tetraethoxypropane with methylhydrazine[1].

References

[1] Peggy W. Alley, David A. Shirley. “The Metalation of 1-Phenyl- and 1-Methylpyrazole with n-Butyllithium.” Journal of the American Chemical Society 80 23 (1958): 6271–6274.

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