Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
(R)-2-Chloro-1-(4-fluorophenyl)ethanol |
EINECS | N/A |
CAS No. | 126534-43-8 | Density | 1.282 g/cm3 |
PSA | 20.23000 | LogP | 2.09790 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H8ClFO | Boiling Point | 256.6 °C at 760 mmHg |
Molecular Weight | 174.602 | Flash Point | 109 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Benzenemethanol,a-(chloromethyl)-4-fluoro-, (R)-;(-)-2-Chloro-1-(4-fluorophenyl)ethanol;(R)-(-)-2-Chloro-1-(4-fluorophenyl)ethanol; |
Article Data | 15 |
The (R)-2-Chloro-1-(4-fluorophenyl)ethanol with the CAS number 126534-43-8 is also called (-)-2-Chloro-1-(4-fluorophenyl)ethanol. The systematic name is benzenemethanol, α-(chloromethyl)-4-fluoro-, (alphaR)-. Its molecular formula is C8H8ClFO.
The properties of the chemical are: (1)ACD/LogP: 1.52; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.52; (4)ACD/LogD (pH 7.4): 1.52; (5)ACD/BCF (pH 5.5): 8.48; (6)ACD/BCF (pH 7.4): 8.48; (7)ACD/KOC (pH 5.5): 160.76; (8)ACD/KOC (pH 7.4): 160.76; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 20.23 Å2; (13)Index of Refraction: 1.532; (14)Molar Refractivity: 42.18 cm3; (15)Molar Volume: 136 cm3; (16)Polarizability: 16.72×10-24cm3; (17)Surface Tension: 41.2 dyne/cm; (18)Enthalpy of Vaporization: 52.21 kJ/mol; (19)Vapour Pressure: 0.00785 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(ccc1[C@H](CCl)O)F
(2)InChI: InChI=1/C8H8ClFO/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4,8,11H,5H2/t8-/m0/s1
(3)InChIKey: VTCREIYEGAGUDS-QMMMGPOBBO