2-chloro-4-methyl-5-(trifluoromethyl)pyridine

2-chloro-4-methyl-5-(trifluoromethyl)pyridine

CAS: 780802-36-0

Formula: C7H5ClF3N

SMILES: CC1=CC(Cl)=NC=C1C(F)(F)F

IUPAC: 2-chloro-4-methyl-5-(trifluoromethyl)pyridine

InChI: InChI=1S/C7H5ClF3N/c1-4-2-6(8)12-3-5(4)7(9,10)11/h2-3H,1H3

Composition: C (42.99%), H (2.58%), Cl (18.13%), F (29.14%), N (7.16%)

Molar Mass: 195.57

Atom Count: 17

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	195.0062614
Formal Charge	0
FSP3	0.29
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	VXQQNFYIASWQGE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	40.78
Topological Polar Surface Area	12.89
Polarizability	14.48
Ring Count	1
Rotatable Bond Count	1

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