1H-Pyrazole-5-carbonitrile, 1,3-dimethyl-


Chemical Name: 1H-Pyrazole-5-carbonitrile, 1,3-dimethyl-
CAS Number: 306936-77-6
Product Number: AG0030XA(AGN-PC-0KK7PZ)
Synonyms:
MDL No:
Molecular Formula: C6H7N3
Molecular Weight: 121.1399

Identification/Properties


Properties
BP:
248.7°C at 760 mmHg
Storage:
Room Temperature;
Computed Properties
Molecular Weight:
121.143g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
121.064g/mol
Monoisotopic Mass:
121.064g/mol
Topological Polar Surface Area:
41.6A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
146
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2810
Hazard Statements:
H301-H311-H331
Precautionary Statements:
P261-P280-P301+P310-P311
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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