Home Nitriles 2-aminoquinoline-4-carbonitrile

2-aminoquinoline-4-carbonitrile

CAS No.:
1232431-62-7
Catalog Number:
AG01BAVA
Molecular Formula:
C10H7N3
Molecular Weight:
169.1827
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Product Description
Catalog Number:
AG01BAVA
Chemical Name:
2-aminoquinoline-4-carbonitrile
CAS Number:
1232431-62-7
Molecular Formula:
C10H7N3
Molecular Weight:
169.1827
MDL Number:
MFCD13181832
IUPAC Name:
2-aminoquinoline-4-carbonitrile
InChI:
InChI=1S/C10H7N3/c11-6-7-5-10(12)13-9-4-2-1-3-8(7)9/h1-5H,(H2,12,13)
InChI Key:
VBQRVUKLTUBQRL-UHFFFAOYSA-N
SMILES:
N#Cc1cc(N)nc2c1cccc2
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.064g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
169.187g/mol
Monoisotopic Mass:
169.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties