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113556-74-4 | 4-Piperidinone, 2,2,6-trimethyl-6-phenyl-
CAS No: 113556-74-4 Catalog No: AG0008Z8 MDL No:
Product Description
Catalog Number:
AG0008Z8
Chemical Name:
4-Piperidinone, 2,2,6-trimethyl-6-phenyl-
CAS Number:
113556-74-4
Molecular Formula:
C14H19NO
Molecular Weight:
217.3068
IUPAC Name:
2,2,6-trimethyl-6-phenylpiperidin-4-one
InChI:
InChI=1S/C14H19NO/c1-13(2)9-12(16)10-14(3,15-13)11-7-5-4-6-8-11/h4-8,15H,9-10H2,1-3H3
InChI Key:
VEKYAQXXTUPFSV-UHFFFAOYSA-N
SMILES:
O=C1CC(C)(NC(C1)(C)C)c1ccccc1
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.147g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.312g/mol
Monoisotopic Mass:
217.147g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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