4-Chloro-6-methyl-2-trichloromethyl-quinoline - CAS 93600-19-2

Catalog:	BB040974
Product Name:	4-Chloro-6-methyl-2-trichloromethyl-quinoline
CAS:	93600-19-2
Synonyms:	4-chloro-6-methyl-2-(trichloromethyl)quinoline

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-chloro-6-methyl-2-(trichloromethyl)quinoline
Description:	4-Chloro-6-methyl-2-trichloromethyl-quinoline (CAS# 93600-19-2) is a useful research chemical.
Molecular Weight:	294.99
Molecular Formula:	C11H7Cl4N
Canonical SMILES:	CC1=CC2=C(C=C1)N=C(C=C2Cl)C(Cl)(Cl)Cl
InChI:	InChI=1S/C11H7Cl4N/c1-6-2-3-9-7(4-6)8(12)5-10(16-9)11(13,14)15/h2-5H,1H3
InChI Key:	GERDLAGWORVXDD-UHFFFAOYSA-N
Boiling Point:	349.7 °C at 760 mmHg
Density:	1.502 g/cm³
LogP:	5.02330

Publication Number	Title	Priority Date
EP-0111329-B1	Fluoromethyl quinoline derivatives and their preparation	19821211
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
SU-1516010-A3	Method of producing chloromethylquinoline derivatives	19821202

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Related Functional Groups

Quinoline/Isoquinoline

[203506-30-3]
2-Amino-6-methoxy-3-methylquinoline
[312713-96-5]
7-Chloro-6-methyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylic acid
[1245816-24-3]
8-(Tributylstannyl)isoquinoline
[4038-97-5]
7-Methoxy-4-(piperazin-1-yl)quinoline
[24782-43-2]
Ethyl 4-hydroxy-2-quinolinecarboxylate
[15785-08-7]
2-Methyl-quinoline-3-carboxylic acid ethyl ester

GHS Hazard Statement:	H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement:	P264, P264+P265, P270, P273, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, P405, and P501
Signal Word:	Danger

Complexity:	253
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	294.93031
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	292.93326
Rotatable Bond Count:	0
Topological Polar Surface Area:	12.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4.8