4-((3-((2-Chloroethyl)amino)propyl)amino)-7-trifluoromethylquinoline d ihydrochloride

Modify Date: 2025-10-04 17:15:00

4-((3-((2-Chloroethyl)amino)propyl)amino)-7-trifluoromethylquinoline d ihydrochloride Structure
4-((3-((2-Chloroethyl)amino)propyl)amino)-7-trifluoromethylquinoline d ihydrochloride structure
Common Name 4-((3-((2-Chloroethyl)amino)propyl)amino)-7-trifluoromethylquinoline d ihydrochloride
CAS Number 38914-93-1 Molecular Weight 404.68600
Density N/A Boiling Point 454.8ºC at 760mmHg
Molecular Formula C15H19Cl3F3N3 Melting Point N/A
MSDS N/A Flash Point 228.9ºC

 Names

Name N-(2-chloroethyl)-N'-[7-(trifluoromethyl)quinolin-4-yl]propane-1,3-diamine,dihydrochloride
Synonym More Synonyms

 Chemical & Physical Properties

Boiling Point 454.8ºC at 760mmHg
Molecular Formula C15H19Cl3F3N3
Molecular Weight 404.68600
Flash Point 228.9ºC
Exact Mass 403.06000
PSA 36.95000
LogP 5.95190
InChIKey BMONXVDJPAQDBC-UHFFFAOYSA-N
SMILES Cl.Cl.FC(F)(F)c1ccc2c(NCCCNCCCl)ccnc2c1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TX7098000
CHEMICAL NAME :
1,3-Propanediamine, N-(2-chloroethyl)-N'-(7-(trifluoromethyl)-4-quinoliny l)-, dihydrochloride
CAS REGISTRY NUMBER :
38914-93-1
LAST UPDATED :
199012
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C15-H17-Cl-F3-N3.2Cl-H
MOLECULAR WEIGHT :
404.72
WISWESSER LINE NOTATION :
T66 BNJ EM3M2G IXFFF &GH 2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD20 - Lethal Dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
101 mg/kg
TOXIC EFFECTS :
Tumorigenic - active as anti-cancer agent
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 15,739,1972

 Synonyms

4-((3-((2-Chloroethyl)amino)propyl)amino)-7-trifluoromethylquinoline dihydrochloride
ICR 380
n-(2-chloroethyl)-n'-[7-(trifluoromethyl)quinolin-4-yl]propane-1,3-diamine dihydrochloride
1,3-Propanediamine,N-(2-chloroethyl)-N'-(7-(trifluoromethyl)-4-quinolinyl)-,dihydrochloride
Quinoline,4-((3-((2-chloroethyl)amino)propyl)amino)-7-trifluoromethyl-,dihydrochloride
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