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Home > Pyridines > 1187164-28-8
1187164-28-8 | 2-Methyl-5-(4-propoxybenzoyl)pyridine
CAS No: 1187164-28-8 Catalog No: AG01FCWQ MDL No:
Product Description
Catalog Number:
AG01FCWQ
Chemical Name:
2-Methyl-5-(4-propoxybenzoyl)pyridine
CAS Number:
1187164-28-8
Molecular Formula:
C16H17NO2
Molecular Weight:
255.3117
IUPAC Name:
(6-methylpyridin-3-yl)-(4-propoxyphenyl)methanone
InChI:
InChI=1S/C16H17NO2/c1-3-10-19-15-8-6-13(7-9-15)16(18)14-5-4-12(2)17-11-14/h4-9,11H,3,10H2,1-2H3
InChI Key:
VWLLRFCVPGHULW-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(cc1)C(=O)c1ccc(nc1)C
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.126g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.317g/mol
Monoisotopic Mass:
255.126g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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