Synonyms: | 1,3-Dioxolane-4-ethanol,2,2-dimethyl-, (R)-;(4R)-4-(2-Hydroxyethyl)-2,2-dimethyl-1,3-dioxolane;2-[(4R)-2,2-Dimethyl-1,3-dioxolan-4-yl]ethanol;2-[(R)-2,2-Dimethyl-[1,3]dioxolan-4-yl]ethanol; |
Specification: |
The (R)-4-(2-Hydroxyethyl)-2,2-dimethyl-1,3-dioxolane, with CAS registry number 70005-89-9, belongs to the following product categories: (1)Chiral Building Blocks; (2)Dioxanes & Dioxolanes; (3)Dioxolanes; (4)Glycidyl Compounds, etc. (Chiral); (5)Synthetic Organic Chemistry; (6)Alcohols; (7)Chiral Building Blocks; (8)Organic Building Blocks.
Physical properties about this chemical are: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 18.39; (5)ACD/KOC (pH 7.4): 18.39; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 3; (9)Polar Surface Area: 27.69 Å2; (10)Index of Refraction: 1.429; (11)Molar Refractivity: 37.22 cm3; (12)Molar Volume: 144.2 cm3; (13)Polarizability: 14.75×10-24cm3; (14)Surface Tension: 35.9 dyne/cm; (15)Enthalpy of Vaporization: 50.89 kJ/mol; (16)Vapour Pressure: 0.0771 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
The (R)-4-(2-Hydroxyethyl)-2,2-dimethyl-1,3-dioxolane irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: OCC[C@H]1OC(OC1)(C)C
(2)InChI: InChI=1/C7H14O3/c1-7(2)9-5-6(10-7)3-4-8/h6,8H,3-5H2,1-2H3/t6-/m1/s1
(3)InChIKey: YYEZYENJAMOWHW-ZCFIWIBFBE
(4)Std. InChI: InChI=1S/C7H14O3/c1-7(2)9-5-6(10-7)3-4-8/h6,8H,3-5H2,1-2H3/t6-/m1/s1
(5)Std. InChIKey: YYEZYENJAMOWHW-ZCFIWIBFSA-N
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