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Home > Pyridines > 1187164-05-1
1187164-05-1 | 3-(4-Hexyloxybenzoyl)-4-methylpyridine
CAS No: 1187164-05-1 Catalog No: AG01FCJJ MDL No:
Product Description
Catalog Number:
AG01FCJJ
Chemical Name:
3-(4-Hexyloxybenzoyl)-4-methylpyridine
CAS Number:
1187164-05-1
Molecular Formula:
C19H23NO2
Molecular Weight:
297.3914
IUPAC Name:
(4-hexoxyphenyl)-(4-methylpyridin-3-yl)methanone
InChI:
InChI=1S/C19H23NO2/c1-3-4-5-6-13-22-17-9-7-16(8-10-17)19(21)18-14-20-12-11-15(18)2/h7-12,14H,3-6,13H2,1-2H3
InChI Key:
RRESOPFBRLCHDY-UHFFFAOYSA-N
SMILES:
CCCCCCOc1ccc(cc1)C(=O)c1cnccc1C
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.173g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.398g/mol
Monoisotopic Mass:
297.173g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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