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116470-85-0 | 4-Piperidinone, 1-chloro-2,6-bis(2-chlorophenyl)-
CAS No: 116470-85-0 Catalog No: AG000CKL MDL No:
Product Description
Catalog Number:
AG000CKL
Chemical Name:
4-Piperidinone, 1-chloro-2,6-bis(2-chlorophenyl)-
CAS Number:
116470-85-0
Molecular Formula:
C17H14Cl3NO
Molecular Weight:
354.6582
IUPAC Name:
1-chloro-2,6-bis(2-chlorophenyl)piperidin-4-one
InChI:
InChI=1S/C17H14Cl3NO/c18-14-7-3-1-5-12(14)16-9-11(22)10-17(21(16)20)13-6-2-4-8-15(13)19/h1-8,16-17H,9-10H2
InChI Key:
QWVCQUWPKUVUGP-UHFFFAOYSA-N
SMILES:
O=C1CC(c2ccccc2Cl)N(C(C1)c1ccccc1Cl)Cl
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.014g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
354.655g/mol
Monoisotopic Mass:
353.014g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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