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Basic Information
CAS No.: 4213-44-9
Name: N~1~,N~1~-bis(2-chloroethyl)-N~4~-(7-chloroquinolin-4-yl)pentane-1,4-diamine dihydrochloride
Molecular Structure:
Molecular Structure of 4213-44-9 (N~1~,N~1~-bis(2-chloroethyl)-N~4~-(7-chloroquinolin-4-yl)pentane-1,4-diamine dihydrochloride)
Formula: C18H24Cl3N3•2ClH
Molecular Weight: 461.72
Boiling Point: 480.8°C at 760 mmHg
Flash Point: 244.6°C
Safety: A deadly poison by intraperitoneal and intravenous routes. Questionable carcinogen with experimental carcinogenic data. Mutation data reported. When heated to decomposition it emits very toxic fumes of Cl− and NOx. See also CHLOROQUINE.
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Chemistry

IUPAC Name: 1-N,1-N-bis(2-Chloroethyl)-4-N-(7-chloroquinolin-4-yl)pentane-1,4-diamine dihydrochloride
Synonyms of Chloroquine mustard (CAS NO.4213-44-9) : Quinoline, 4-[(4-[bis(2-chloroethyl)amino]-1-methylbutyl)amino]-7-chloro-, dihydrochloride ; 1,4-Pentanediamine, N1,N1-bis(2-chloroethyl)-N4-(7-chloro-4-quinolinyl)-, dihydrochloride (9CI) ; 4-((4-(Bis(2-chloroethyl)amino)-1-methylbutyl)amino)-7-chloroquinoline dihydrochloride
CAS NO:4213-44-9
Molecular Formula:C18H26Cl5N3
Molecular Weight :461.6841
Molecular Structure :
Flash Point: 244.6 °C
Enthalpy of Vaporization: 74.54 kJ/mol
Boiling Point: 480.8 °C at 760 mmHg
Vapour Pressure: 2.1E-09 mmHg at 25°C

Uses

 Chloroquine mustard (CAS NO.4213-44-9) is is used as  intermediate in organic synthesis.

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LDLo intravenous 200ug/kg (0.2mg/kg) BLOOD: OTHER CHANGES Cancer Chemotherapy Reports, Part 2. Vol. 2, Pg. 202, 1965.
monkey LDLo intravenous 410ug/kg (0.41mg/kg) BLOOD: OTHER CHANGES Cancer Chemotherapy Reports, Part 2. Vol. 2, Pg. 202, 1965.
mouse LD50 intraperitoneal 7mg/kg (7mg/kg)   Cancer Research. Vol. 21, Pg. 1124, 1961.
rat LD10 intraperitoneal 1100ug/kg (1.1mg/kg)   Cancer Chemotherapy Reports. Vol. 17, Pg. 63, 1962.

Safety Profile

A deadly poison by intraperitoneal and intravenous routes. Questionable carcinogen with experimental carcinogenic data. Mutation data reported. When  Chloroquine mustard (CAS NO.4213-44-9) is heated to decomposition ,it emits very toxic fumes of Cl− and NOx. See also CHLOROQUINE.