1-(3-chloro-4-fluorobenzoyl)piperidin-4-one

1-(3-chloro-4-fluorobenzoyl)piperidin-4-one

CAS: 223632-64-2

Formula: C12H11ClFNO2

SMILES: FC1=CC=C(C=C1Cl)C(=O)N1CCC(=O)CC1

IUPAC: 1-(3-chloro-4-fluorobenzoyl)piperidin-4-one

InChI: InChI=1S/C12H11ClFNO2/c13-10-7-8(1-2-11(10)14)12(17)15-5-3-9(16)4-6-15/h1-2,7H,3-6H2

Composition: C (56.37%), H (4.34%), Cl (13.87%), F (7.43%), N (5.48%), O (12.52%)

Molar Mass: 255.67

Atom Count: 28

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	255.0462345
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	FODGPXWJTNUVJU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.43
Topological Polar Surface Area	37.38
Polarizability	23.4
Ring Count	2
Rotatable Bond Count	1

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