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167705-56-8 | 4-Piperidinone, 2-phenyl-1-(phenylmethyl)-
CAS No: 167705-56-8 Catalog No: AG001XK3 MDL No:MFCD09029795
Product Description
Catalog Number:
AG001XK3
Chemical Name:
4-Piperidinone, 2-phenyl-1-(phenylmethyl)-
CAS Number:
167705-56-8
Molecular Formula:
C18H19NO
Molecular Weight:
265.3496
MDL Number:
MFCD09029795
IUPAC Name:
1-benzyl-2-phenylpiperidin-4-one
InChI:
InChI=1S/C18H19NO/c20-17-11-12-19(14-15-7-3-1-4-8-15)18(13-17)16-9-5-2-6-10-16/h1-10,18H,11-14H2
InChI Key:
SXBALVCQZRIWQR-UHFFFAOYSA-N
SMILES:
O=C1CCN(C(C1)c1ccccc1)Cc1ccccc1
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.147g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.356g/mol
Monoisotopic Mass:
265.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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