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| CAS No.: | 637-39-8 |
|---|---|
| Name: | TRIETHANOLAMINE HYDROCHLORIDE |
| Article Data: | 16 |
| Molecular Structure: | |
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| Formula: | C6H16ClNO3 |
| Molecular Weight: | 185.651 |
| Synonyms: | Ethanol,2,2',2''-nitrilotri-, hydrochloride (8CI);Ethanol, 2,2',2''-nitrilotris-,hydrochloride (9CI);2-[Bis(2-hydroxyethyl)amino]ethanol hydrochloride;Triethanolamine hydrochloric acid salt;Triethanolamine hydrochloride;Triethanolammonium chloride;Tris(2-hydroxyethyl)amine hydrochloride;Tris(2-hydroxyethyl)ammonium chloride; |
| EINECS: | 211-284-2 |
| Density: | 1.354[at 20℃] |
| Melting Point: | 177-179 °C(lit.) |
| Boiling Point: | 335.4 °C at 760 mmHg |
| Flash Point: | 185 °C |
| Solubility: | Soluble in water. |
| Appearance: | White/clear crystalline powder |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 22-24/25-36-26 |
| PSA: | 63.93000 |
| LogP: | -0.93270 |
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Specification
The 2,2',2''-Nitrilotriethanol hydrochloride, with the CAS registry number 637-39-8, is also known as Ethanol, 2,2',2''-nitrilotri-, hydrochloride. Its EINECS registry number is 211-284-2. This chemical's molecular formula is C6H16ClNO3 and molecular weight is 185.64914. Its IUPAC name is called 2-[bis(2-hydroxyethyl)amino]ethanol hydrochloride. This chemical is white/clear crystalline powder. The product should be sealed and stored in cool and dry place. What's more, it should be protected from strong oxides. This chemical can be used as fine chemical raw materials, pharmaceutical intermediates, organic synthesis. This chemical's classification code is Tumor data.
Physical properties of 2,2',2''-Nitrilotriethanol hydrochloride: (1)ACD/LogP: -1.11; (2)ACD/LogD (pH 5.5): -3.39; (3)ACD/LogD (pH 7.4): -1.69; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1.57; (8)#H bond acceptors: 4; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 9; (11)Flash Point: 185 °C; (12)Enthalpy of Vaporization: 67.02 kJ/mol; (13)Boiling Point: 335.4 °C at 760 mmHg; (14)Vapour Pressure: 8.38E-06 mmHg at 25°C.
Uses of 2,2',2''-Nitrilotriethanol hydrochloride: it can be used to produce 7-ethyl-indole at temperature of 180 °C. This reaction will need reagent SnCl2•2H2O and solvent dioxane, H2O with reaction time of 20 hours. The yield is about 87%.
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When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. 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. Whenever you will contact it, please wear suitable protective clothing.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C(CO)N(CCO)CCO.Cl
(2)InChI: InChI=1S/C6H15NO3.ClH/c8-4-1-7(2-5-9)3-6-10;/h8-10H,1-6H2;1H
(3)InChIKey: HHLJUSLZGFYWKW-UHFFFAOYSA-N