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| CAS No.: | 53104-32-8 |
|---|---|
| Name: | (5-AMINO-2,2-DIMETHYL-[1,3]DIOXAN-5-YL)-METHANOL |
| Molecular Structure: | |
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| Formula: | C7H15NO3 |
| Molecular Weight: | 161.201 |
| Synonyms: | (5-Amino-2,2-dimethyl-1,3-dioxan-5-yl)methanol; |
| Density: | 1.063g/cm3 |
| Melting Point: | 55 °C |
| Boiling Point: | 241.5 °C at 760 mmHg |
| Flash Point: | 99.8 °C |
| PSA: | 64.71000 |
| LogP: | 0.15940 |
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Specification
The 1,3-Dioxane-5-methanol,5-amino-2,2-dimethyl-, with the CAS registry number 53104-32-8, is also known as (5-Amino-2,2-dimethyl-1,3-dioxan-5-yl)methanol. It belongs to the product category of Pharmacetical. This chemical's molecular formula is C7H15NO3 and molecular weight is 161.1989.
Physical properties about 1,3-Dioxane-5-methanol,5-amino-2,2-dimethyl- are: (1)ACD/LogP: -0.51; (2)#of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 30.93Å2; (7)Index of Refraction: 1.449; (8)Molar Refractivity: 40.66 cm3; (9)Molar Volume: 151.5 cm3; (10)Surface Tension: 42.8 dyne/cm; (11)Density: 1.063 g/cm3; (12)Flash Point: 99.8 °C; (13)Enthalpy of Vaporization: 55.6 kJ/mol; (14)Boiling Point: 241.5 °C at 760 mmHg; (15)Vapour Pressure: 0.00617 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: OCC1(N)COC(OC1)(C)C
(2) InChI: InChI=1/C7H15NO3/c1-6(2)10-4-7(8,3-9)5-11-6/h9H,3-5,8H2,1-2H3
(3) InChIKey: FZKNPLIAARFREX-UHFFFAOYAW