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Home > Pyridines > 147675-03-4
147675-03-4 | 3-Pyridinecarbonitrile, 1,2-dihydro-4,6-dimethyl-2-oxo-5-(2-phenyldiazenyl)-
CAS No: 147675-03-4 Catalog No: AG001F2I MDL No:
Product Description
Catalog Number:
AG001F2I
Chemical Name:
3-Pyridinecarbonitrile, 1,2-dihydro-4,6-dimethyl-2-oxo-5-(2-phenyldiazenyl)-
CAS Number:
147675-03-4
Molecular Formula:
C14H12N4O
Molecular Weight:
252.2713
IUPAC Name:
4,6-dimethyl-2-oxo-5-phenyldiazenyl-1H-pyridine-3-carbonitrile
InChI:
InChI=1S/C14H12N4O/c1-9-12(8-15)14(19)16-10(2)13(9)18-17-11-6-4-3-5-7-11/h3-7H,1-2H3,(H,16,19)
InChI Key:
NAZSGKKZTJGELQ-UHFFFAOYSA-N
SMILES:
N#Cc1c(=O)[nH]c(c(c1C)N=Nc1ccccc1)C
Properties
Complexity:
527
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.101g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
252.277g/mol
Monoisotopic Mass:
252.101g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
77.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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