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Home > Pyridines > 1187170-25-7
1187170-25-7 | 5-Methyl-2-(4-Propylbenzoyl)pyridine
CAS No: 1187170-25-7 Catalog No: AG01FDEF MDL No:
Product Description
Catalog Number:
AG01FDEF
Chemical Name:
5-Methyl-2-(4-Propylbenzoyl)pyridine
CAS Number:
1187170-25-7
Molecular Formula:
C16H17NO
Molecular Weight:
239.3123
IUPAC Name:
(5-methylpyridin-2-yl)-(4-propylphenyl)methanone
InChI:
InChI=1S/C16H17NO/c1-3-4-13-6-8-14(9-7-13)16(18)15-10-5-12(2)11-17-15/h5-11H,3-4H2,1-2H3
InChI Key:
ZUTUIJLPTGOVIF-UHFFFAOYSA-N
SMILES:
CCCc1ccc(cc1)C(=O)c1ccc(cn1)C
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.131g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.318g/mol
Monoisotopic Mass:
239.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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