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113604-61-8 | 2,6-Piperidinedione, 3-(4-chlorophenyl)-4-phenyl-
CAS No: 113604-61-8 Catalog No: AG000951 MDL No:
Product Description
Catalog Number:
AG000951
Chemical Name:
2,6-Piperidinedione, 3-(4-chlorophenyl)-4-phenyl-
CAS Number:
113604-61-8
Molecular Formula:
C17H14ClNO2
Molecular Weight:
299.7516
IUPAC Name:
3-(4-chlorophenyl)-4-phenylpiperidine-2,6-dione
InChI:
InChI=1S/C17H14ClNO2/c18-13-8-6-12(7-9-13)16-14(10-15(20)19-17(16)21)11-4-2-1-3-5-11/h1-9,14,16H,10H2,(H,19,20,21)
InChI Key:
IYXMDBJFYLFLAD-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C(C(C1)c1ccccc1)c1ccc(cc1)Cl
Properties
Complexity:
398
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.071g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
299.754g/mol
Monoisotopic Mass:
299.071g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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