1-(4-Fluorophenyl)-2-methylpropan-2-ol supplier

Name
1-(4-FLUORO-PHENYL)-2-METHYL-PROPAN-2-OL
EINECS
CAS No. 2928-17-8
Article Data4
CAS DataBase
Density 1.071 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₃FO
Boiling Point 235.3 °C at 760 mmHg
Molecular Weight 168.21
Flash Point 117.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-(4-Fluorophenyl)-1,1-dimethylethanol;Benzeneethanol, 4-fluoro-α,α-dimethyl-;Phenethyl alcohol, p-fluoro-α,α-dimethyl- (6CI);1-(4-Fluorophenyl)-2-methyl-2-propanol;
PSA 20.23000
LogP 2.13910

1-(4-Fluorophenyl)-2-methylpropan-2-ol Specification

This product is an organic compound with the formula C₁₀H₁₃FO. The systematic name of this chemical is 1-(4-Fluorophenyl)-2-methylpropan-2-ol. With the CAS registry number 2928-17-8, it is also named as 2-(4-Fluorophenyl)-1,1-dimethylethanol. In addition, the molecular weight is 168.21.

Physical properties of 1-(4-Fluorophenyl)-2-methylpropan-2-ol are: (1)ACD/LogP: 2.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.11; (4)ACD/LogD (pH 7.4): 2.11; (5)ACD/BCF (pH 5.5): 23.54; (6)ACD/BCF (pH 7.4): 23.54; (7)ACD/KOC (pH 5.5): 333.85; (8)ACD/KOC (pH 7.4): 333.85; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.504; (14)Molar Refractivity: 46.56 cm³; (15)Molar Volume: 157 cm³; (16)Polarizability: 18.45×10^-24cm³; (17)Surface Tension: 35.1 dyne/cm; (18)Density: 1.071 g/cm³; (19)Flash Point: 117.9 °C; (20)Enthalpy of Vaporization: 49.89 kJ/mol; (21)Boiling Point: 235.3 °C at 760 mmHg; (22)Vapour Pressure: 0.0278 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccc(cc1)CC(O)(C)C
(2)InChI: InChI=1S/C10H13FO/c1-10(2,12)7-8-3-5-9(11)6-4-8/h3-6,12H,7H2,1-2H3
(3)InChIKey: DWRIANGNJXQAAT-UHFFFAOYSA-N

Product Name

1-(4-FLUORO-PHENYL)-2-METHYL-PROPAN-2-OL

1-(4-Fluorophenyl)-2-methylpropan-2-ol Specification

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