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Home > Pyridines > 303162-27-8
303162-27-8 | Ethanone, 1-(3,5-dimethylphenyl)-2-[2-(phenylmethoxy)-4-pyridinyl]-
CAS No: 303162-27-8 Catalog No: AG002ZO9 MDL No:
Product Description
Catalog Number:
AG002ZO9
Chemical Name:
Ethanone, 1-(3,5-dimethylphenyl)-2-[2-(phenylmethoxy)-4-pyridinyl]-
CAS Number:
303162-27-8
Molecular Formula:
C22H21NO2
Molecular Weight:
331.4076
IUPAC Name:
1-(3,5-dimethylphenyl)-2-(2-phenylmethoxypyridin-4-yl)ethanone
InChI:
InChI=1S/C22H21NO2/c1-16-10-17(2)12-20(11-16)21(24)13-19-8-9-23-22(14-19)25-15-18-6-4-3-5-7-18/h3-12,14H,13,15H2,1-2H3
InChI Key:
UYFUCYNHVAUKLQ-UHFFFAOYSA-N
SMILES:
Cc1cc(C)cc(c1)C(=O)Cc1ccnc(c1)OCc1ccccc1
Properties
Complexity:
408
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.157g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
331.415g/mol
Monoisotopic Mass:
331.157g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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