4,6-Dichloro-2-trichloromethyl-quinoline - CAS 93600-20-5

Catalog:	BB040975
Product Name:	4,6-Dichloro-2-trichloromethyl-quinoline
CAS:	93600-20-5
Synonyms:	4,6-dichloro-2-(trichloromethyl)quinoline

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4,6-dichloro-2-(trichloromethyl)quinoline
Description:	4,6-Dichloro-2-trichloromethyl-quinoline (CAS# 93600-20-5 ) is a useful research chemical.
Molecular Weight:	315.41
Molecular Formula:	C10H4Cl5N
Canonical SMILES:	C1=CC2=C(C=C1Cl)C(=CC(=N2)C(Cl)(Cl)Cl)Cl
InChI:	InChI=1S/C10H4Cl5N/c11-5-1-2-8-6(3-5)7(12)4-9(16-8)10(13,14)15/h1-4H
InChI Key:	FHXKVGZILZNOCZ-UHFFFAOYSA-N
Boiling Point:	354.6 °C at 760 mmHg
Density:	1.642 g/cm³
LogP:	5.36830

Publication Number	Title	Priority Date
EP-0113432-A1	Chloromethyl quinoline derivatives, process for their preparation and their use	19821202
EP-0113432-B1	Chloromethyl quinoline derivatives, process for their preparation and their use	19821202
HU-191508-B	Process for preparing new chloromethyl-quinoline derivatives	19821202
RU-2012560-C1	Method of synthesis of chloromethylquinoline derivatives	19821202
SU-1516010-A3	Method of producing chloromethylquinoline derivatives	19821202

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Related Functional Groups

Quinoline/Isoquinoline

[938459-19-9]
2-Chloro-4-methyl-7-(methylthio)quinoline
[361982-79-8]
2-Chloro-4-methyl-7,8-dihydro-6H-cyclopenta[g]quinoline
[91092-92-1]
3-Carbomethoxy-1,2,3,4-tetrahydroisoquinoline-1,4-dione
[927800-47-3]
4-Chloro-6-fluoro-2-trichloromethyl-quinoline
[13676-02-3]
2-Chloro-6-methoxyquinoline
[77156-78-6]
4-Hydroxy-6-methoxyquinoline-3-carboxylic acid ethyl ester

GHS Hazard Statement:	H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]; H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement:	P264, P270, P273, P301+P316, P321, P330, P405, and P501
Signal Word:	Danger

Complexity:	254
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	314.875687
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	312.878638
Rotatable Bond Count:	0
Topological Polar Surface Area:	12.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	5.1