2-chloro-5-(trifluoromethyl)benzoyl chloride

2-chloro-5-(trifluoromethyl)benzoyl chloride

CAS: 657-05-6

Formula: C8H3Cl2F3O

SMILES: FC(F)(F)C1=CC=C(Cl)C(=C1)C(Cl)=O

IUPAC: 2-chloro-5-(trifluoromethyl)benzoyl chloride

InChI: InChI=1S/C8H3Cl2F3O/c9-6-2-1-4(8(11,12)13)3-5(6)7(10)14/h1-3H

Composition: C (39.54%), H (1.24%), Cl (29.18%), F (23.45%), O (6.58%)

Molar Mass: 243.01

Atom Count: 17

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	241.9513046
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	FRARPACTAFPNNL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.95
Topological Polar Surface Area	17.07
Polarizability	17.47
Ring Count	1
Rotatable Bond Count	2

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