Home Nitriles 2-Quinolinecarbonitrile,4-methyl-

2-Quinolinecarbonitrile,4-methyl-

CAS No.:
10590-69-9
Catalog Number:
AG0084Y0
Molecular Formula:
C11H8N2
Molecular Weight:
168.1946
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Product Description
Catalog Number:
AG0084Y0
Chemical Name:
2-Quinolinecarbonitrile,4-methyl-
CAS Number:
10590-69-9
Molecular Formula:
C11H8N2
Molecular Weight:
168.1946
MDL Number:
MFCD08705686
IUPAC Name:
4-methylquinoline-2-carbonitrile
InChI:
InChI=1S/C11H8N2/c1-8-6-9(7-12)13-11-5-3-2-4-10(8)11/h2-6H,1H3
InChI Key:
MLZSCKRIEGYCKD-UHFFFAOYSA-N
SMILES:
N#Cc1cc(C)c2c(n1)cccc2
Properties
Complexity:
228  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.069g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.199g/mol
Monoisotopic Mass:
168.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties