Home Nitriles 1-cyclopropyl-2-oxo-1,2-dihydropyridine-3-carbonitrile

1-cyclopropyl-2-oxo-1,2-dihydropyridine-3-carbonitrile

CAS No.:
1267956-49-9
Catalog Number:
AG01BJK3
Molecular Formula:
C9H8N2O
Molecular Weight:
160.1726
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Product Description
Catalog Number:
AG01BJK3
Chemical Name:
1-cyclopropyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
CAS Number:
1267956-49-9
Molecular Formula:
C9H8N2O
Molecular Weight:
160.1726
MDL Number:
MFCD19313330
IUPAC Name:
1-cyclopropyl-2-oxopyridine-3-carbonitrile
InChI:
InChI=1S/C9H8N2O/c10-6-7-2-1-5-11(9(7)12)8-3-4-8/h1-2,5,8H,3-4H2
InChI Key:
ABJDCTFTNZTPKU-UHFFFAOYSA-N
SMILES:
N#Cc1cccn(c1=O)C1CC1
Properties
Complexity:
328  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.064g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.176g/mol
Monoisotopic Mass:
160.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties