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CAS No.: | 86527-10-8 |
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Name: | (1R)-1-(2-THIENYL)ETHANOL |
Article Data: | 154 |
Molecular Structure: | |
Formula: | C6H8OS |
Molecular Weight: | 128.195 |
Synonyms: | 2-Thiophenemethanol,a-methyl-, (R)-;(R)-1-(2-Thienyl)ethanol;(aR)-a-Methyl-2-thiophenemethanol; |
Density: | 1.166g/cm3 |
Boiling Point: | 212.77 °C at 760 mmHg |
Flash Point: | 82.481 °C |
Hazard Symbols: | Xn |
Risk Codes: | 22-37/38-41 |
Safety: | 26-39 |
PSA: | 48.47000 |
LogP: | 1.80140 |
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The 2-Thiophenemethanol,a-methyl-, (aR)-, with CAS registry number 86527-10-8, belongs to the following product categories: (1)Alcohols, Hydroxy Esters and Derivatives; (2)Chiral Compounds. It has the systematic name of (1R)-1-(2-thienyl)ethanol. This chemical should be stored at the temperature of 2-8°C. And the chemical formula of this chemical is C6H8OS.
Physical properties of 2-Thiophenemethanol,a-methyl-, (aR)-: (1)ACD/LogP: 1.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 4; (6)ACD/BCF (pH 7.4): 4; (7)ACD/KOC (pH 5.5): 90; (8)ACD/KOC (pH 7.4): 90; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 48.47 Å2; (13)Index of Refraction: 1.563; (14)Molar Refractivity: 35.724 cm3; (15)Molar Volume: 109.985 cm3; (16)Polarizability: 14.162×10-24cm3; (17)Surface Tension: 43.479 dyne/cm; (18)Density: 1.166 g/cm3; (19)Flash Point: 82.481 °C; (20)Enthalpy of Vaporization: 47.471 kJ/mol; (21)Boiling Point: 212.77 °C at 760 mmHg; (22)Vapour Pressure: 0.101 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
The Trimesic acid irritates to eyes, respiratory system and skin. This chemical is harmful if swallowed. And it has risk of serious damage to the eyes. 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: CC(c1cccs1)O
(2)InChI: InChI=1/C6H8OS/c1-5(7)6-3-2-4-8-6/h2-5,7H,1H3/t5-/m1/s1
(3)InChIKey: WUNFIVTVJXZDDJ-RXMQYKEDBE
(4)Std. InChI: InChI=1S/C6H8OS/c1-5(7)6-3-2-4-8-6/h2-5,7H,1H3/t5-/m1/s1
(5)Std. InChIKey: WUNFIVTVJXZDDJ-RXMQYKEDSA-N