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5-(4-chlorophenyl)-3-[(4-chlorophenyl)amino]cyclohex-2-en-1-one

5-(4-chlorophenyl)-3-[(4-chlorophenyl)amino]cyclohex-2-en-1-one

Formula: C18H15Cl2NO

SMILES: ClC1=CC=C(NC2=CC(=O)CC(C2)C2=CC=C(Cl)C=C2)C=C1

IUPAC: 5-(4-chlorophenyl)-3-[(4-chlorophenyl)amino]cyclohex-2-en-1-one

InChI: InChI=1/C18H15Cl2NO/c19-14-3-1-12(2-4-14)13-9-17(11-18(22)10-13)21-16-7-5-15(20)6-8-16/h1-8,11,13,21H,9-10H2

Composition: C (65.08%), H (4.55%), Cl (21.34%), N (4.22%), O (4.82%)

Molar Mass: 332.22

Atom Count: 37

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 331.0530695
Formal Charge 0
FSP3 0.17
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey BVDLZPMYJKYNLU-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 93.63
Topological Polar Surface Area 29.1
Polarizability 34.92
Ring Count 3
Rotatable Bond Count 3

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H15Cl2NO $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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