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CAS No.: | 2162-31-4 |
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Name: | 2-(TETRAHYDRO-2H-PYRAN-2-YLOXY)ETHANOL |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C7H14O3 |
Molecular Weight: | 146.186 |
Synonyms: | 2-[(Tetrahydro-2H-pyran-2-yl)oxy]ethanol;Ethylene glycolmono(tetrahydropyranyl ether);2-(Tetrahydropyranyloxy)ethanol;2-Hydroxyethyl tetrahydropyranyl ether;2-(2-Hydroxyethoxy)tetrahydropyran;2-(Tetrahydropyran-2-yloxy)ethanol;Ethanol,2-[(tetrahydropyran-2-yl)oxy]- (7CI);1-Hydroxy-2-(2-tetrahydropyranyloxy)ethane; |
Density: | 1.07 g/cm3 |
Melting Point: | 95 °C 22 mm Hg(lit.) |
Boiling Point: | 255.3 °C at 760 mmHg |
Flash Point: | 108.2 °C |
Safety: | 23-24/25 |
PSA: | 38.69000 |
LogP: | 0.52190 |
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The CAS registry number of Ethanol,2-[(tetrahydro-2H-pyran-2-yl)oxy]- is 2162-31-4. It belongs to the product categories of API intermediates; Nitric Oxide Reagents; Cross Linking Reagents. This chemical is also named as 2-(2-Hydroxyethoxy)tetrahydropyran. In addition, its molecular formula is C7H14O3 and molecular weight is 146.18. Its systematic name is called 2-(tetrahydro-2H-pyran-2-yloxy)ethanol. Do not breathe gas/fumes/vapour/spray (appropriate wording to be specified by the manufacturer). Also you should avoid contact with skin and eyes.
Physical properties about this chemical are: (1)ACD/LogP: -0.39; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.39; (4)ACD/LogD (pH 7.4): -0.39; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 14.7; (8)ACD/KOC (pH 7.4): 14.7; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Index of Refraction: 1.459; (13)Molar Refractivity: 37.4 cm3; (14)Molar Volume: 136.6 cm3; (15)Surface Tension: 36.7 dyne/cm; (16)Density: 1.07 g/cm3; (17)Flash Point: 108.2 °C; (18)Enthalpy of Vaporization: 57.24 kJ/mol; (19)Boiling Point: 255.3 °C at 760 mmHg; (20)Vapour Pressure: 0.00249 mmHg at 25°C.
Preparation: this chemical can be prepared by 3,4-dihydro-2H-pyran and ethane-1,2-diol. This reaction will need reagent I2 and solvent tetrahydrofuran. The reaction time is 150 s with reaction temperature of 67 °C. The yield is about 78 %. It also needs irradiation.
Uses of Ethanol,2-[(tetrahydro-2H-pyran-2-yl)oxy]-: it can be used to produce 1-p-Tosyl-2-(2-tetrahydropyranyloxy)aethan at temperature of 5 °C. It will need reagent triethylamine and solvent CH2Cl2 with reaction time of 24 hours. The yield is about 99 %.
You can still convert the following datas into molecular structure:
(1)SMILES: O(CCO)C1OCCCC1
(2)InChI: InChI=1/C7H14O3/c8-4-6-10-7-3-1-2-5-9-7/h7-8H,1-6H2
(3)InChIKey: XDBZJXRPEKFIFR-UHFFFAOYAM