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Home > Pyridines > 140942-11-6
140942-11-6 | Propanedinitrile, 2-(5-cyano-2-methyl[3,4'-bipyridin]-6(1H)-ylidene)-
CAS No: 140942-11-6 Catalog No: AG001FOD MDL No:
Product Description
Catalog Number:
AG001FOD
Chemical Name:
Propanedinitrile, 2-(5-cyano-2-methyl[3,4'-bipyridin]-6(1H)-ylidene)-
CAS Number:
140942-11-6
Molecular Formula:
C15H9N5
Molecular Weight:
259.2655
IUPAC Name:
2-(3-cyano-6-methyl-5-pyridin-4-yl-1H-pyridin-2-ylidene)propanedinitrile
InChI:
InChI=1S/C15H9N5/c1-10-14(11-2-4-19-5-3-11)6-12(7-16)15(20-10)13(8-17)9-18/h2-6,20H,1H3
InChI Key:
WMKTXIWJYICRHT-UHFFFAOYSA-N
SMILES:
N#CC(=c1[nH]c(C)c(cc1C#N)c1ccncc1)C#N
Properties
Complexity:
641
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.086g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
259.272g/mol
Monoisotopic Mass:
259.086g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
96.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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