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Home > Pyridines > 1187169-01-2
1187169-01-2 | 4-(4-Butoxybenzoyl)-2-methylpyridine
CAS No: 1187169-01-2 Catalog No: AG01FDE2 MDL No:
Product Description
Catalog Number:
AG01FDE2
Chemical Name:
4-(4-Butoxybenzoyl)-2-methylpyridine
CAS Number:
1187169-01-2
Molecular Formula:
C17H19NO2
Molecular Weight:
269.3383
IUPAC Name:
(4-butoxyphenyl)-(2-methylpyridin-4-yl)methanone
InChI:
InChI=1S/C17H19NO2/c1-3-4-11-20-16-7-5-14(6-8-16)17(19)15-9-10-18-13(2)12-15/h5-10,12H,3-4,11H2,1-2H3
InChI Key:
NQASOZJXGWMGOM-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(cc1)C(=O)c1ccnc(c1)C
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.142g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.344g/mol
Monoisotopic Mass:
269.142g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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