2-Chloro-5-(chlorodifluoromethyl)pyridine - CAS 71701-84-3

Catalog:	BB034458
Product Name:	2-Chloro-5-(chlorodifluoromethyl)pyridine
CAS:	71701-84-3
Synonyms:	2-chloro-5-[chloro(difluoro)methyl]pyridine; 2-chloro-5-[chloro(difluoro)methyl]pyridine

Technical Data

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Computed Properties

IUPAC Name:	2-chloro-5-[chloro(difluoro)methyl]pyridine
Description:	2-Chloro-5-(chlorodifluoromethyl)pyridine (CAS# 71701-84-3) is useful in the synthesis of herbicides.
Molecular Weight:	198.00
Molecular Formula:	C6H3Cl2F2N
Canonical SMILES:	C1=CC(=NC=C1C(F)(F)Cl)Cl
InChI:	InChI=1S/C6H3Cl2F2N/c7-5-2-1-4(3-11-5)6(8,9)10/h1-3H
InChI Key:	WXQQAFKXPWZPKW-UHFFFAOYSA-N
LogP:	3.02310

Publication Number	Title	Priority Date
EP-3330253-A1	Pyridine-2-yl-pyridinium compound and method of using same	20150728
EP-3330253-B1	Pyridine-2-yl-pyridinium compound and method of using same	20150728
JP-6528159-B2	Pyridin-2-yl pyridinium compounds and methods of using the same	20150728
JP-WO2017018409-A1	Pyridin-2-ylpyridinium compound and method of use thereof	20150728
KR-102020161-B1	Pyridine-2-yl-pyridinium compound and method of using same	20150728

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]; H412 (100%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	143
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	196.9610608
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	196.9610608
Rotatable Bond Count:	1
Topological Polar Surface Area:	12.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9