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Home > Pyridines > 338966-40-8
338966-40-8 | 4-(2-methoxyphenyl)-2,6-dimethylpyridine-3,5-dicarbonitrile
CAS No: 338966-40-8 Catalog No: AG00IQ46 MDL No:MFCD00663831
Product Description
Catalog Number:
AG00IQ46
Chemical Name:
4-(2-methoxyphenyl)-2,6-dimethylpyridine-3,5-dicarbonitrile
CAS Number:
338966-40-8
Molecular Formula:
C16H13N3O
Molecular Weight:
263.2939
MDL Number:
MFCD00663831
IUPAC Name:
4-(2-methoxyphenyl)-2,6-dimethylpyridine-3,5-dicarbonitrile
InChI:
InChI=1S/C16H13N3O/c1-10-13(8-17)16(14(9-18)11(2)19-10)12-6-4-5-7-15(12)20-3/h4-7H,1-3H3
InChI Key:
VKYJJFNBPMZSEQ-UHFFFAOYSA-N
SMILES:
COc1ccccc1c1c(C#N)c(C)nc(c1C#N)C
Properties
Complexity:
404
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.106g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.3g/mol
Monoisotopic Mass:
263.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
69.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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