4-chloro-1H-pyrazole-5-carbonitrile


Chemical Name: 4-chloro-1H-pyrazole-5-carbonitrile
CAS Number: 36650-75-6
Product Number: AG00CN4P(AGN-PC-07T7DJ)
Synonyms:
MDL No:
Molecular Formula: C4H2ClN3
Molecular Weight: 127.5318

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
127.531g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
126.994g/mol
Monoisotopic Mass:
126.994g/mol
Topological Polar Surface Area:
52.5A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
127
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:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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