1-(4-bromophenyl)-3-(4-chlorophenyl)propan-1-one

1-(4-bromophenyl)-3-(4-chlorophenyl)propan-1-one

CAS: 296271-45-9

Formula: C15H12BrClO

SMILES: ClC1=CC=C(CCC(=O)C2=CC=C(Br)C=C2)C=C1

IUPAC: 1-(4-bromophenyl)-3-(4-chlorophenyl)propan-1-one

InChI: InChI=1S/C15H12BrClO/c16-13-6-4-12(5-7-13)15(18)10-3-11-1-8-14(17)9-2-11/h1-2,4-9H,3,10H2

Composition: C (55.67%), H (3.74%), Br (24.69%), Cl (10.95%), O (4.94%)

Molar Mass: 323.61

Atom Count: 30

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	321.976006
Formal Charge	0
FSP3	0.13
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	AAQWRXMBFZVSIQ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	78.21
Topological Polar Surface Area	17.07
Polarizability	30.09
Ring Count	2
Rotatable Bond Count	4

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