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CAS No.: | 38260-01-4 |
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Name: | TRIETHYLENETETRAMINE DIHYDROCHLORIDE |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C6H20Cl2N4 |
Molecular Weight: | 219.158 |
Synonyms: | N,N'-bis(2-aminoethyl)ethane-1,2-diamine dihydrochloride;1,2-ethanediamine, N1,N2-bis(2-aminoethyl)-, hydrochloride (1:2);N,N'-Bis(2-aminoethyl)-1,2-ethanediamine dihydrochloride;n,n'-bis(2-aminoethyl)ethan-1,2-diamindihydrochlorid;1,2-Ethanediamine, N,N'-bis(2-aminoethyl)-, dihydrochloride; |
EINECS: | 253-854-3 |
Density: | 0.958 g/cm3 |
Melting Point: | 120-125 °C (dec.) |
Boiling Point: | 266.5 °C at 760 mmHg |
Flash Point: | 143.3 °C |
Appearance: | white crystalline powder |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26 |
PSA: | 76.10000 |
LogP: | 1.86940 |
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The 1,2-Ethanediamine,N1,N2-bis(2-aminoethyl)-, hydrochloride (1:2), with the CAS registry number 38260-01-4, is also known as N,N'-Bis(2-aminoethyl)-1,2-ethanediamine dihydrochloride.Its EINECS number is 253-854-3. This chemical's molecular formula is C6H20Cl2N4 and molecular weight is 219.16. What's more, its systematic name is N,N'-bis(2-aminoethyl)ethane-1,2-diamine dihydrochloride. Its classification codes are: (1)Chelating agent; (2)Reproductive Effect. It should be sealed and stored in cool and dry places at the temperature 0-6 °C.
Physical properties of 1,2-Ethanediamine,N1,N2-bis(2-aminoethyl)-, hydrochloride (1:2) are: (1)ACD/LogP: -2.18; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -7; (4)ACD/LogD (pH 7.4): -6.24; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 6; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 12.96 Å2; (13)Flash Point: 143.3 °C; (14)Enthalpy of Vaporization: 50.45 kJ/mol; (15)Boiling Point: 266.5 °C at 760 mmHg; (16)Vapour Pressure: 0.00861 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: Cl.Cl.NCCNCCNCCN
(2)InChI: InChI=1/C6H18N4.2ClH/c7-1-3-9-5-6-10-4-2-8;;/h9-10H,1-8H2;2*1H
(3)InChIKey: WYHIICXRPHEJKI-UHFFFAOYAV
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
rat | LD50 | oral | 2285mg/kg (2285mg/kg) | LUNGS, THORAX, OR RESPIRATION: CYANOSIS LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES GASTROINTESTINAL: ULCERATION OR BLEEDING FROM STOMACH | Toxicology Letters. Vol. (Suppl), Pg. 246, 1992. |