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Home > Pyridines > 102147-20-6
102147-20-6 | 3-Pyridinecarbonitrile, 2-methyl-4-phenyl-
CAS No: 102147-20-6 Catalog No: AG0006Q8 MDL No:MFCD01325607
Product Description
Catalog Number:
AG0006Q8
Chemical Name:
3-Pyridinecarbonitrile, 2-methyl-4-phenyl-
CAS Number:
102147-20-6
Molecular Formula:
C13H10N2
Molecular Weight:
194.2319
MDL Number:
MFCD01325607
IUPAC Name:
2-methyl-4-phenylpyridine-3-carbonitrile
InChI:
InChI=1S/C13H10N2/c1-10-13(9-14)12(7-8-15-10)11-5-3-2-4-6-11/h2-8H,1H3
InChI Key:
ABIZYBUWUINJEP-UHFFFAOYSA-N
SMILES:
N#Cc1c(C)nccc1c1ccccc1
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.084g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.237g/mol
Monoisotopic Mass:
194.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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