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824938-72-9 | 4-Piperidinone, 2-(4-methoxyphenyl)-1-(phenylmethyl)-
CAS No: 824938-72-9 Catalog No: AG004VD9 MDL No:
Product Description
Catalog Number:
AG004VD9
Chemical Name:
4-Piperidinone, 2-(4-methoxyphenyl)-1-(phenylmethyl)-
CAS Number:
824938-72-9
Molecular Formula:
C19H21NO2
Molecular Weight:
295.3755
IUPAC Name:
1-benzyl-2-(4-methoxyphenyl)piperidin-4-one
InChI:
InChI=1S/C19H21NO2/c1-22-18-9-7-16(8-10-18)19-13-17(21)11-12-20(19)14-15-5-3-2-4-6-15/h2-10,19H,11-14H2,1H3
InChI Key:
GUWWSVMOVFBYII-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1CC(=O)CCN1Cc1ccccc1
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.157g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.382g/mol
Monoisotopic Mass:
295.157g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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