4-chloro-1-(4-fluorophenyl)butan-1-one

4-chloro-1-(4-fluorophenyl)butan-1-one

CAS: 3874-54-2

Formula: C10H10ClFO

SMILES: FC1=CC=C(C=C1)C(=O)CCCCl

IUPAC: 4-chloro-1-(4-fluorophenyl)butan-1-one

InChI: InChI=1S/C10H10ClFO/c11-7-1-2-10(13)8-3-5-9(12)6-4-8/h3-6H,1-2,7H2

Composition: C (59.86%), H (5.02%), Cl (17.67%), F (9.47%), O (7.97%)

Molar Mass: 200.64

Atom Count: 23

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	200.0404208
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	HXAOUYGZEOZTJO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.88
Topological Polar Surface Area	17.07
Polarizability	19.27
Ring Count	1
Rotatable Bond Count	4

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