2-Chloro-4-iodo-6-(trifluoromethyl)pyridine - CAS 205444-22-0

Name: 2-Chloro-4-iodo-6-(trifluoromethyl)pyridine
Brand: BOC Sciences
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Catalog:	BB016053
Product Name:	2-Chloro-4-iodo-6-(trifluoromethyl)pyridine
CAS:	205444-22-0
Synonyms:	2-chloro-4-iodo-6-(trifluoromethyl)pyridine; 2-chloro-4-iodo-6-(trifluoromethyl)pyridine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-chloro-4-iodo-6-(trifluoromethyl)pyridine
Description:	2-Chloro-4-iodo-6-(trifluoromethyl)pyridine (CAS# 205444-22-0) is a useful research chemical.
Molecular Weight:	307.44
Molecular Formula:	C6H2ClF3IN
Canonical SMILES:	C1=C(C=C(N=C1C(F)(F)F)Cl)I
InChI:	InChI=1S/C6H2ClF3IN/c7-5-2-3(11)1-4(12-5)6(8,9)10/h1-2H
InChI Key:	JHKQSKCFLAXPKK-UHFFFAOYSA-N
Boiling Point:	230.469 °C at 760 mmHg
Density:	2.047 g/cm³
MDL:	MFCD10699394
LogP:	3.35840

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Related Functional Groups

Pyridines

[1018141-88-2]C17H14N4O2
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[1951441-75-0]C8H13ClN2O
2-(6-Methoxypyridin-2-yl)ethan-1-amine hydrochloride
[1018125-51-3]C12H12F3N3O2
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[149463-07-0]C6H6Cl2FN
2-(Chloromethyl)-3-fluoropyridine Hydrochloride
[1202402-53-6]C9H12BrNO
2-[6-(Bromomethyl)-2-pyridyl]-2-propanol
[4926-28-7]C6H6BrN
2-Bromo-4-methylpyridine

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2021134004-A1	Cyclic compounds and methods of using same	20191227
WO-2021123291-A1	Oga inhibitor compounds	20191218
WO-2021094312-A1	Pyrrolidine and bicycloheteroaryl containing oga inhibitor compounds	20191111
US-2021139517-A1	Bicyclic heteroaryl compounds and uses thereof	20191108
WO-2021092115-A1	Bicyclic heteroaryl compounds and uses thereof	20191108

Complexity:	163
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	306.88726
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	306.88726
Rotatable Bond Count:	0
Topological Polar Surface Area:	12.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.4