Home Nitriles 1,8-naphthyridine-3-carbonitrile

1,8-naphthyridine-3-carbonitrile

CAS No.:
1142927-39-6
Catalog Number:
AG01BAV2
Molecular Formula:
C9H5N3
Molecular Weight:
155.1561
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Product Description
Catalog Number:
AG01BAV2
Chemical Name:
1,8-naphthyridine-3-carbonitrile
CAS Number:
1142927-39-6
Molecular Formula:
C9H5N3
Molecular Weight:
155.1561
MDL Number:
MFCD18802345
IUPAC Name:
1,8-naphthyridine-3-carbonitrile
InChI:
InChI=1S/C9H5N3/c10-5-7-4-8-2-1-3-11-9(8)12-6-7/h1-4,6H
InChI Key:
LKSJXDPHTNUEIJ-UHFFFAOYSA-N
SMILES:
N#Cc1cnc2c(c1)cccn2
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.048g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
155.16g/mol
Monoisotopic Mass:
155.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties