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Home > Pyridines > 1187168-42-8
1187168-42-8 | 2-(2,5-Dimethylbenzoyl)-6-methoxypyridine
CAS No: 1187168-42-8 Catalog No: AG01FBI5 MDL No:
Product Description
Catalog Number:
AG01FBI5
Chemical Name:
2-(2,5-Dimethylbenzoyl)-6-methoxypyridine
CAS Number:
1187168-42-8
Molecular Formula:
C15H15NO2
Molecular Weight:
241.2851
IUPAC Name:
(2,5-dimethylphenyl)-(6-methoxypyridin-2-yl)methanone
InChI:
InChI=1S/C15H15NO2/c1-10-7-8-11(2)12(9-10)15(17)13-5-4-6-14(16-13)18-3/h4-9H,1-3H3
InChI Key:
NKQGMAOMIXBBOT-UHFFFAOYSA-N
SMILES:
COc1cccc(n1)C(=O)c1cc(C)ccc1C
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.11g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.29g/mol
Monoisotopic Mass:
241.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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