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3-Chloro-5-(trifluoromethyl)pyridine-2-carbonitrile

3-Chloro-5-(trifluoromethyl)pyridine-2-carbonitrile - CAS 80194-70-3

Catalog:	BB036474
Product Name:	3-Chloro-5-(trifluoromethyl)pyridine-2-carbonitrile
CAS:	80194-70-3
Synonyms:	3-chloro-5-(trifluoromethyl)-2-pyridinecarbonitrile; 3-chloro-5-(trifluoromethyl)pyridine-2-carbonitrile

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3-chloro-5-(trifluoromethyl)pyridine-2-carbonitrile
Description:	3-Chloro-5-(trifluoromethyl)pyridine-2-carbonitrile (CAS# 80194-70-3) is a useful research chemical.
Molecular Weight:	206.55
Molecular Formula:	C7H2ClF3N2
Canonical SMILES:	C1=C(C=NC(=C1Cl)C#N)C(F)(F)F
InChI:	InChI=1S/C7H2ClF3N2/c8-5-1-4(7(9,10)11)3-13-6(5)2-12/h1,3H
InChI Key:	FUPKVFJSGNZICR-UHFFFAOYSA-N
Boiling Point:	250.4 °C at 760 mmHg
Density:	1.51 g/cm³
MDL:	MFCD00664066
LogP:	2.62548

Publication Number	Title	Priority Date
CN-112552231-A	Synthetic method of 2- (3-chloro-5- (trifluoromethyl) pyridine-2-yl) ethylamine	20201211
CN-112390746-A	Method for inhibiting generation of 2-cyano-3-chloro-5-trifluoromethylpyridine precursor impurity	20201103
CN-112390747-A	Combined preparation method of 2-cyano-3-chloro-5-trifluoromethylpyridine and succinonitrile	20201103
CN-112390748-A	Preparation method of 2-cyano-3-fluoro-5-trifluoromethylpyridine	20201103
CN-213493653-U	2-cyano-3-chlorine-5-trifluoromethyl pyridine continuous reaction device	20200831

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Related Functional Groups

Nitrogen Compounds

[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[32894-07-8]
Benzyl thioacetimidate hydrochloride
[937273-31-9]
2-[(Allyloxy)methyl]-1-(2-chloroethoxy)-4-nitrobenzene
[55877-31-1]
1-Benzofuran-3-carbonitrile
[618-40-6]
1-Methyl-1-phenylhydrazine
[916792-07-9]
2-Bromo-4-fluoro-5-methylbenzonitrile

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

Complexity:	232
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	205.9858603
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	205.9858603
Rotatable Bond Count:	0
Topological Polar Surface Area:	36.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.4