6-Chloro-3-fluoro-2-(trifluoromethyl)pyridine - CAS 1227511-58-1

Catalog:	BB005480
Product Name:	6-Chloro-3-fluoro-2-(trifluoromethyl)pyridine
CAS:	1227511-58-1
Synonyms:	6-chloro-3-fluoro-2-(trifluoromethyl)pyridine; 6-chloro-3-fluoro-2-(trifluoromethyl)pyridine

Technical Data

Patents

Computed Properties

IUPAC Name:	6-chloro-3-fluoro-2-(trifluoromethyl)pyridine
Description:	6-Chloro-3-fluoro-2-(trifluoromethyl)pyridine (CAS# 1227511-58-1) is a useful research chemical.
Molecular Weight:	199.53
Molecular Formula:	C6H2ClF4N
Canonical SMILES:	C1=CC(=NC(=C1F)C(F)(F)F)Cl
InChI:	InChI=1S/C6H2ClF4N/c7-4-2-1-3(8)5(12-4)6(9,10)11/h1-2H
InChI Key:	IAMZZUGNIRVXSJ-UHFFFAOYSA-N
LogP:	2.89290

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Complexity:	160
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	198.9811894
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	198.9811894
Rotatable Bond Count:	0
Topological Polar Surface Area:	12.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8