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Home > Pyridines > 1187166-20-6
1187166-20-6 | 2-(3,5-Dimethylbenzoyl)-3-methylpyridine
CAS No: 1187166-20-6 Catalog No: AG01FBU0 MDL No:
Product Description
Catalog Number:
AG01FBU0
Chemical Name:
2-(3,5-Dimethylbenzoyl)-3-methylpyridine
CAS Number:
1187166-20-6
Molecular Formula:
C15H15NO
Molecular Weight:
225.2857
IUPAC Name:
(3,5-dimethylphenyl)-(3-methylpyridin-2-yl)methanone
InChI:
InChI=1S/C15H15NO/c1-10-7-11(2)9-13(8-10)15(17)14-12(3)5-4-6-16-14/h4-9H,1-3H3
InChI Key:
SEZWSMFICWBWDT-UHFFFAOYSA-N
SMILES:
Cc1cc(C)cc(c1)C(=O)c1ncccc1C
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.115g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.291g/mol
Monoisotopic Mass:
225.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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