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| CAS No.: | 99528-42-4 |
|---|---|
| Name: | (S)-4-CHLORO-ALPHA-METHYLBENZYL ALCOHOL |
| Article Data: | 350 |
| Molecular Structure: | |
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| Formula: | C8H9ClO |
| Molecular Weight: | 156.612 |
| Synonyms: | Benzenemethanol,4-chloro-a-methyl-, (S)-;(-)-1-(4-Chlorophenyl)ethanol;(-)-1-(p-Chlorophenyl)ethanol;(1S)-1-(4-Chlorophenyl)ethanol;(S)-(-)-1-(p-Chlorophenyl)ethanol;(S)-1-(4-Chlorophenyl)ethanol;(S)-1-(p-Chlorophenyl)ethanol;(aS)-4-chloro-a-methylbenzenemethanol;S-4-Chloro-a-methylbenzyl alcohol;S-4'-Chlorophenylethanol; |
| Density: | 1.182 g/cm3 |
| Boiling Point: | 240.6 °C at 760 mmHg |
| Flash Point: | 99.3 °C |
| Hazard Symbols: |
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| Risk Codes: | 20/21/22-36/37/38 |
| Safety: | 26 |
| PSA: | 20.23000 |
| LogP: | 2.39330 |
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Specification
The (S)-1-(4-Chlorophenyl)ethanol with its cas register number is 99528-42-4. It also can be called as Benzenemethanol,4-chloro-a-methyl-, (aS)- and the Systematic name about this chemical is 1-(4-chlorophenyl)ethanol. It belongs to the following product categories, such as Alcohols, Hydroxy Esters and Derivatives, Chiral Compounds, API intermediates and so on.
Physical properties about (S)-1-(4-Chlorophenyl)ethanol are: (1)ACD/LogP: 1.98; (2)ACD/LogD (pH 5.5): 1.98; (3)ACD/LogD (pH 7.4): 1.98; (4)ACD/BCF (pH 5.5): 18.73; (5)ACD/BCF (pH 7.4): 18.73; (6)ACD/KOC (pH 5.5): 283.47; (7)ACD/KOC (pH 7.4): 283.47; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 9.23Å2; (12)Index of Refraction: 1.55; (13)Molar Refractivity: 42.23 cm3; (14)Molar Volume: 132.4 cm3; (15)Polarizability: 16.74x10-24cm3; (16)Surface Tension: 40.9 dyne/cm; (17)Enthalpy of Vaporization: 50.46 kJ/mol; (18)Vapour Pressure: 0.0204 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical is harmful by inhalation, in contact with skin and if swallowed and it is irritating to eyes, respiratory system and skin. In case of 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: Clc1ccc(cc1)C(O)C
(2)InChI: InChI=1/C8H9ClO/c1-6(10)7-2-4-8(9)5-3-7/h2-6,10H,1H3
(3)InChIKey: MVOSNPUNXINWAD-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C8H9ClO/c1-6(10)7-2-4-8(9)5-3-7/h2-6,10H,1H3
(5)Std. InChIKey: MVOSNPUNXINWAD-UHFFFAOYSA-N