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102147-20-6,MFCD01325607
Catalog No.:AA0006NG
102147-20-6 | 2-Methyl-4-phenylnicotinonitrile
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1g
95%
in stock  
$74.00   $52.00
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5g
95%
in stock  
$212.00   $148.00
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Technical Information
Catalog Number:
AA0006NG
Chemical Name:
2-Methyl-4-phenylnicotinonitrile
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
Computed 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  

Synonyms
 
2-METHYL-4-PHENYLNICOTINONITRILE 
102147-20-6 
ZX-CM008782 
MFCD01325607 
AKOS006343067 
MCULE-5752453923 
AJ-53969 
W-8188 
CID3808725 
2-methyl-4-phenyl-pyridine-3-carbonitrile 
3-Pyridinecarbonitrile, 2-methyl-4-phenyl- 
2-methyl-4-phenylpyridine-3-carbonitrile 
ACMC-20m55t 
AC1MX22W 
SCHEMBL17971409 
CTK0G7773 
DTXSID90396722 
ZINC5394129 
Literature
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