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Basic Information
CAS No.: 817-09-4
Name: TRIS(2-CHLOROETHYL)AMINE HYDROCHLORIDE
Article Data: 27
Molecular Structure:
Molecular Structure of 817-09-4 (TRIS(2-CHLOROETHYL)AMINE HYDROCHLORIDE)
Formula: C6H12 Cl3 N . Cl H
Molecular Weight: 240.988
Synonyms: Ethanamine,2-chloro-N,N-bis(2-chloroethyl)-, hydrochloride (9CI); Triethylamine, 2,2',2''-trichloro-,hydrochloride (8CI); 2,2',2''-Trichlorotriethylamine hydrochloride;2-Chloro-N,N-bis(2-chloroethyl)ethanammonium chloride; NSC 30211; R 47;Sinalost; Tri(2-chloroethyl)amine hydrochloride; Tri(b-chloroethyl)amine hydrochloride;Trichlormethin; Trillekamin; Trimitan; Trimustine; Tris(2-chloroethyl)aminehydrochloride; Tris(b-chloroethyl)amine hydrochloride
Melting Point: 127-130 °C(lit.)
Boiling Point: 156.2°C at 760 mmHg
Flash Point: 48.3°C
Hazard Symbols:
Risk Codes: 28-34-40
Safety: Poison by ingestion, subcutaneous, intravenous, and intraperitoneal routes. Human systemic effects by ingestion and intravenous routes: somnolence, anorexia, headache, thrombosis distant from injection site, nausea or vomiting, and leukopenia. Experimental reproductive effects. Mutation data reported. Questionable carcinogen with experimental carcinogenic data. When heated to decomposition it emits very toxic fumes of Cl, NH3, and NOx. Used as an antineoplastic agent.
PSA: 3.24000
LogP: 2.80680
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Chemistry

Product Name: Tris(2-chloroethyl)ammonium chloride (CAS NO.817-09-4)


Molecular Formula: C6H13Cl4N
Molecular Weight: 240.99g/mol
Mol File: 817-09-4.mol
Einecs: 212-442-3
Appearance: White to off-white crystalline powder
Melting Point: 127-130 °C(lit.)
Boiling point: 156.2 °C at 760 mmHg
Storage Temperature: Poison room
Flash Point: 48.3 °C
Enthalpy of Vaporization: 39.29 kJ/mol
Vapour Pressure: 2.92 mmHg at 25°C
H-Bond Donor: 1
H-Bond Acceptor: 1
Product Categories: Amine Salts; Nitrogen Compounds; Organic Building Blocks

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD75 intravenous 1mg/kg (1mg/kg) GASTROINTESTINAL: ULCERATION OR BLEEDING FROM SMALL INTESTINE

GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"

GASTROINTESTINAL: NAUSEA OR VOMITING
Journal of Pharmacology and Experimental Therapeutics. Vol. 90, Pg. 277, 1947.
human TDLo intravenous 100ug/kg (0.1mg/kg) BEHAVIORAL: HEADACHE

VASCULAR: THROMBOSIS DISTANT FROM INJECTION SITE

GASTROINTESTINAL: NAUSEA OR VOMITING
National Technical Information Service. Vol. PB158-507,
human TDLo oral 30ug/kg (0.03mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: ANOREXIA (HUMAN

GASTROINTESTINAL: NAUSEA OR VOMITING
National Technical Information Service. Vol. PB158-507,
human TDLo oral 214ug/kg (0.214mg/kg) BLOOD: LEUKOPENIA National Technical Information Service. Vol. PB158-507,
mouse LD50 intraperitoneal 1600ug/kg (1.6mg/kg)   Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 230, Pg. 559, 1957.
mouse LD50 oral 1100ug/kg (1.1mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 9, Pg. 595, 1959.
mouse LD50 subcutaneous 2mg/kg (2mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 91, Pg. 224, 1947.
rabbit LD50 intravenous 2500ug/kg (2.5mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 91, Pg. 224, 1947.
rabbit LDLo oral 2mg/kg (2mg/kg) GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS British Journal of Pharmacology and Chemotherapy. Vol. 1, Pg. 247, 1946.
rat LD50 intraperitoneal 750ug/kg (0.75mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 8, Pg. 807, 1960.
rat LD50 intravenous 700ug/kg (0.7mg/kg)   National Technical Information Service. Vol. PB158-507,
rat LD50 subcutaneous 2mg/kg (2mg/kg)   National Technical Information Service. Vol. PB158-507,
rat LDLo oral 5mg/kg (5mg/kg)   National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 19, 1953.

Consensus Reports

IARC Cancer Review: Group 3 IMEMDT    IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 7 ,1987,p. 56.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) ; Animal Inadequate Evidence IMEMDT    IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 9 ,1975,p. 229.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) . EPA Genetic Toxicology Program.

Safety Profile

Poison by ingestion, subcutaneous, intravenous, and intraperitoneal routes. Human systemic effects by ingestion and intravenous routes: somnolence, anorexia, headache, thrombosis distant from injection site, nausea or vomiting, and leukopenia. Experimental reproductive effects. Mutation data reported. Questionable carcinogen with experimental carcinogenic data. When heated to decomposition it emits very toxic fumes of Cl, NH3, and NOx. Used as an antineoplastic agent.
Safety Information of Tris(2-chloroethyl)ammonium chloride (CAS NO.817-09-4):
Hazard Codes: T+,Xi
Risk Statements: 28-34-40
28:  Very Toxic if swallowed
34:  Causes burns
40:  Limited evidence of a carcinogenic effect
Safety Statements: 26-28-36/37/39-45
26:  In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
28:  After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer)
36:  Wear suitable protective clothing  
37:  Wear suitable gloves 
39:  Wear eye/face protection 
45:  In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) 

Specification

 Tris(2-chloroethyl)ammonium chloride ,its CAS NO. is 817-09-4,the synonyms is Tris(2-chloroethyl)amine hydrochloride ; b,b',b''-Trichlorotriethylamine hydrochloride ; 2,2',2''-Trichlorotriethylamine hydrochloride ; 2,2',2"-Trichloro-triethylaminhydrochloride ; 2-Chloro-n,n-bis(2-chloroethyl)-ethanaminhydrochloride ; Ethanamine,2-chloro-n,n-bis[2-chloroethyl]-,hydrochloride ; Hn3hydrochloride ; Lekamin .