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Home > Pyridines > 1187170-95-1
1187170-95-1 | 2-(2,5-Dimethylbenzoyl)-3-methylpyridine
CAS No: 1187170-95-1 Catalog No: AG01FBWJ MDL No:
Product Description
Catalog Number:
AG01FBWJ
Chemical Name:
2-(2,5-Dimethylbenzoyl)-3-methylpyridine
CAS Number:
1187170-95-1
Molecular Formula:
C15H15NO
Molecular Weight:
225.2857
IUPAC Name:
(2,5-dimethylphenyl)-(3-methylpyridin-2-yl)methanone
InChI:
InChI=1S/C15H15NO/c1-10-6-7-11(2)13(9-10)15(17)14-12(3)5-4-8-16-14/h4-9H,1-3H3
InChI Key:
UZJUGSVCDXSIFQ-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)C(=O)c1ncccc1C)C
Properties
Complexity:
276
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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