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CAS No.: | 4728-06-7 |
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Name: | 1,3-Dioxane-4-methanol |
Molecular Structure: | |
Formula: | C5H10O3 |
Molecular Weight: | 118.1311 |
Synonyms: | m-Dioxane-4-methanol(8CI); |
Density: | 1.102 g/cm3 |
Boiling Point: | 199.6 °C at 760 mmHg |
Flash Point: | 91.3 °C |
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The 1,3-Dioxane-4-methanol is an organic compound with the formula C5H10O3. The systematic name of this chemical is 1,3-Dioxan-4-ylmethanol. The CAS registry number of this chemical is 4728-06-7. Besides, its molecular weight is 118.1311.
Physical properties about 1,3-Dioxane-4-methanol are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 8.55; (4)ACD/KOC (pH 7.4): 8.55; (5)#H bond acceptors: 3; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: 38.69 Å2; (9)Index of Refraction: 1.433; (10)Molar Refractivity: 27.88 cm3; (11)Molar Volume: 107.1 cm3; (12)Polarizability: 11.05×10-24 cm3; (13)Surface Tension: 40.6 dyne/cm; (14)Density: 1.102 g/cm3; (15)Flash Point: 91.3 °C; (16)Enthalpy of Vaporization: 50.71 kJ/mol; (17)Boiling Point: 199.6 °C at 760 mmHg; (18)Vapour Pressure: 0.0847 mmHg at 25 °C.
Preparation: this chemical can be prepared by Dimethoxymethane and Butane-1,2,4-triol. The yield is about 100%.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C5H10O3/c6-3-5-1-2-7-4-8-5/h5-6H,1-4H2
(2)InChIKey: TXJCQKSWDOLICI-UHFFFAOYAS
(3)Std. InChI: InChI=1S/C5H10O3/c6-3-5-1-2-7-4-8-5/h5-6H,1-4H2
(4)Std. InChIKey: TXJCQKSWDOLICI-UHFFFAOYSA-N