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Home > Pyridines > 579475-83-5
579475-83-5 | Benzonitrile, 3-(2-ethyl-6-methyl-4-pyridinyl)- (9CI)
CAS No: 579475-83-5 Catalog No: AG00EO7W MDL No:
Product Description
Catalog Number:
AG00EO7W
Chemical Name:
Benzonitrile, 3-(2-ethyl-6-methyl-4-pyridinyl)- (9CI)
CAS Number:
579475-83-5
IUPAC Name:
3-(2-ethyl-6-methylpyridin-4-yl)benzonitrile
InChI:
InChI=1S/C15H14N2/c1-3-15-9-14(7-11(2)17-15)13-6-4-5-12(8-13)10-16/h4-9H,3H2,1-2H3
InChI Key:
KCSRSZOSVPDXAX-UHFFFAOYSA-N
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.116g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.291g/mol
Monoisotopic Mass:
222.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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