Home Nitriles 4H-Pyrazolo[1,5-a]benzimidazole-3-carbonitrile(9CI)

4H-Pyrazolo[1,5-a]benzimidazole-3-carbonitrile(9CI)

CAS No.:
64096-91-9
Catalog Number:
AG00EL9Q
Molecular Formula:
C10H6N4
Molecular Weight:
182.1814
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Product Description
Catalog Number:
AG00EL9Q
Chemical Name:
4H-Pyrazolo[1,5-a]benzimidazole-3-carbonitrile(9CI)
CAS Number:
64096-91-9
Molecular Formula:
C10H6N4
Molecular Weight:
182.1814
MDL Number:
MFCD18820290
IUPAC Name:
1H-pyrazolo[1,5-a]benzimidazole-3-carbonitrile
InChI:
InChI=1S/C10H6N4/c11-5-7-6-12-14-9-4-2-1-3-8(9)13-10(7)14/h1-4,6,12H
InChI Key:
AQFUNDWLSQYOOR-UHFFFAOYSA-N
SMILES:
N#Cc1cnn2c1[nH]c1c2cccc1
Properties
Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.059g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
182.186g/mol
Monoisotopic Mass:
182.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
56.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties