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Home > Pyridines > 1187168-74-6
1187168-74-6 | 4-(3-Methylbenzoyl)-2-methylpyridine
CAS No: 1187168-74-6 Catalog No: AG01FDE0 MDL No:
Product Description
Catalog Number:
AG01FDE0
Chemical Name:
4-(3-Methylbenzoyl)-2-methylpyridine
CAS Number:
1187168-74-6
Molecular Formula:
C14H13NO
Molecular Weight:
211.2591
IUPAC Name:
(3-methylphenyl)-(2-methylpyridin-4-yl)methanone
InChI:
InChI=1S/C14H13NO/c1-10-4-3-5-12(8-10)14(16)13-6-7-15-11(2)9-13/h3-9H,1-2H3
InChI Key:
WXYZENKQTXRCKG-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)C(=O)c1ccnc(c1)C
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.1g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.264g/mol
Monoisotopic Mass:
211.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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