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Home > Pyridines > 1187165-27-0
1187165-27-0 | 2-(4-Heptyloxybenzoyl)-6-methoxypyridine
CAS No: 1187165-27-0 Catalog No: AG01FBTF MDL No:
Product Description
Catalog Number:
AG01FBTF
Chemical Name:
2-(4-Heptyloxybenzoyl)-6-methoxypyridine
CAS Number:
1187165-27-0
Molecular Formula:
C20H25NO3
Molecular Weight:
327.4174
IUPAC Name:
(4-heptoxyphenyl)-(6-methoxypyridin-2-yl)methanone
InChI:
InChI=1S/C20H25NO3/c1-3-4-5-6-7-15-24-17-13-11-16(12-14-17)20(22)18-9-8-10-19(21-18)23-2/h8-14H,3-7,15H2,1-2H3
InChI Key:
GWQHMIQOLJNGDX-UHFFFAOYSA-N
SMILES:
CCCCCCCOc1ccc(cc1)C(=O)c1cccc(n1)OC
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.183g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
327.424g/mol
Monoisotopic Mass:
327.183g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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