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2-chloro-5-(trifluoromethyl)pyridine-3-carbonyl chloride

2-chloro-5-(trifluoromethyl)pyridine-3-carbonyl chloride

CAS: 1099597-75-7

Formula: C7H2Cl2F3NO

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

IUPAC: 2-chloro-5-(trifluoromethyl)pyridine-3-carbonyl chloride

InChI: InChI=1S/C7H2Cl2F3NO/c8-5-4(6(9)14)1-3(2-13-5)7(10,11)12/h1-2H

Composition: C (34.46%), H (0.83%), Cl (29.06%), F (23.36%), N (5.74%), O (6.56%)

Molar Mass: 243.99

Atom Count: 16

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 242.9465536
Formal Charge 0
FSP3 0.14
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey CEQQAPUZEUIPCH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.86
Topological Polar Surface Area 29.96
Polarizability 16.78
Ring Count 1
Rotatable Bond Count 2

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