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834155-06-5 | 4-Piperidinone, 1-(2-phenylethyl)-3-(phenylmethyl)-
CAS No: 834155-06-5 Catalog No: AG004VJY MDL No:
Product Description
Catalog Number:
AG004VJY
Chemical Name:
4-Piperidinone, 1-(2-phenylethyl)-3-(phenylmethyl)-
CAS Number:
834155-06-5
Molecular Formula:
C20H23NO
Molecular Weight:
293.4027
IUPAC Name:
3-benzyl-1-(2-phenylethyl)piperidin-4-one
InChI:
InChI=1S/C20H23NO/c22-20-12-14-21(13-11-17-7-3-1-4-8-17)16-19(20)15-18-9-5-2-6-10-18/h1-10,19H,11-16H2
InChI Key:
GYNJJJSCBNDSDY-UHFFFAOYSA-N
SMILES:
O=C1CCN(CC1Cc1ccccc1)CCc1ccccc1
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.178g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.41g/mol
Monoisotopic Mass:
293.178g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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