3'-Fluoro-2'-hydroxyacetophenone supplier

Name
3''-Fluoro-2''-Hydroxyacetophenone
EINECS
CAS No. 699-92-3
Article Data12
CAS DataBase
Density 1.247 g/cm³
Solubility
Melting Point 72-73 °C
Formula C₈H₇FO₂
Boiling Point 209.004 °C at 760 mmHg
Molecular Weight 154.141
Flash Point 80.203 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-(3-Fluoro-2-hydroxyphenyl)-ethanone;1-(3-Fluoro-2-hydroxyphenyl)ethanone;Ethanone, 1-(3-fluoro-2-hydroxyphenyl)-;
PSA 37.30000
LogP 1.73390

3'-Fluoro-2'-hydroxyacetophenone Specification

The 3''-Fluoro-2''-Hydroxyacetophenone, with the CAS registry number 699-92-3, has the systematic name and IUPAC name of 1-(3-fluoro-2-hydroxyphenyl)ethanone. It is a kind of organics, and the molecular formula of the chemical is C₈H₇FO₂.

The characteristics of 3''-Fluoro-2''-Hydroxyacetophenone are as followings: (1)ACD/LogP: 2.24; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 30; (6)ACD/BCF (pH 7.4): 29; (7)ACD/KOC (pH 5.5): 395; (8)ACD/KOC (pH 7.4): 383; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 37.3 Å²; (13)Index of Refraction: 1.53; (14)Molar Refractivity: 38.156 cm³; (15)Molar Volume: 123.603 cm³; (16)Polarizability: 15.126×10^-24cm³; (17)Surface Tension: 41.964 dyne/cm; (18)Density: 1.247 g/cm³; (19)Flash Point: 80.203 °C; (20)Enthalpy of Vaporization: 46.344 kJ/mol; (21)Boiling Point: 209.004 °C at 760 mmHg; (22)Vapour Pressure: 0.144 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Fc1cccc(C(=O)C)c1O
(2)InChI: InChI=1/C8H7FO2/c1-5(10)6-3-2-4-7(9)8(6)11/h2-4,11H,1H3
(3)InChIKey: WXTHZWWWCICGAN-UHFFFAOYAQ

Product Name

3''-Fluoro-2''-Hydroxyacetophenone

3'-Fluoro-2'-hydroxyacetophenone Specification

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