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89757-51-7 | 4-Piperidinone, 3,3-dimethyl-2,6-diphenyl-, hydrochloride
CAS No: 89757-51-7 Catalog No: AG0040TS MDL No:
Product Description
Catalog Number:
AG0040TS
Chemical Name:
4-Piperidinone, 3,3-dimethyl-2,6-diphenyl-, hydrochloride
CAS Number:
89757-51-7
Molecular Formula:
C19H22ClNO
Molecular Weight:
315.8371
IUPAC Name:
3,3-dimethyl-2,6-diphenylpiperidin-4-one;hydrochloride
InChI:
InChI=1S/C19H21NO.ClH/c1-19(2)17(21)13-16(14-9-5-3-6-10-14)20-18(19)15-11-7-4-8-12-15;/h3-12,16,18,20H,13H2,1-2H3;1H
InChI Key:
PZYWRJUPJCFBDL-UHFFFAOYSA-N
SMILES:
O=C1CC(NC(C1(C)C)c1ccccc1)c1ccccc1.Cl
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.139g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
315.841g/mol
Monoisotopic Mass:
315.139g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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