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10131-61-0

10131-61-0 | 3-Pyridinecarbonitrile, 2-methyl-6-(phenylmethyl)-

CAS No: 10131-61-0 Catalog No: AG00047H MDL No:

Product Description

Catalog Number:
AG00047H
Chemical Name:
3-Pyridinecarbonitrile, 2-methyl-6-(phenylmethyl)-
CAS Number:
10131-61-0
Molecular Formula:
C14H12N2
Molecular Weight:
208.2585
IUPAC Name:
6-benzyl-2-methylpyridine-3-carbonitrile
InChI:
InChI=1S/C14H12N2/c1-11-13(10-15)7-8-14(16-11)9-12-5-3-2-4-6-12/h2-8H,9H2,1H3
InChI Key:
AVJXPTUIMVMOEV-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(nc1C)Cc1ccccc1

Properties

Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.1g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.264g/mol
Monoisotopic Mass:
208.1g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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