CAS No.126581-65-5,2-BROMO-1-(5-FLUORO-2-HYDROXYPHENYL)ETHANONE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	126581-65-5
Name:	2-BROMO-1-(5-FLUORO-2-HYDROXYPHENYL)ETHANONE
Article Data:	8

Formula:	C₈H₆BrFO₂
Molecular Weight:	233.037
Synonyms:	2-Bromo-1-(5-fluoro-2-hydroxyphenyl)ethanone;5-Fluoro-2-hydroxyphenacyl bromide;2-Bromo-5'-fluoro-2'-hydroxyacetophenone;alpha-Bromo-(2-hydroxy-5-fluoro)acetophenone;
Density:	1.703 g/cm³
Melting Point:	87-91 °C
Boiling Point:	290.6 °C at 760 mmHg
Flash Point:	129.5 °C
Hazard Symbols:	Xn,C
Risk Codes:	22
PSA:	37.30000
LogP:	2.10890

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Specification

The Ethanone,2-bromo-1-(5-fluoro-2-hydroxyphenyl)-, with the CAS registry number 126581-65-5, is also known as alpha-Bromo-(2-hydroxy-5-fluoro)acetophenone. This chemical's molecular formula is C₈H₆BrFO₂ and molecular weight is 233.03. What's more, its systematic name is 2-bromo-1-(5-fluoro-2-hydroxyphenyl)ethanone. It is harmful if swallowed.

Physical properties of Ethanone,2-bromo-1-(5-fluoro-2-hydroxyphenyl)- are: (1)ACD/LogP: 2.83; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.82; (4)ACD/LogD (pH 7.4): 2.58; (5)ACD/BCF (pH 5.5): 82.17; (6)ACD/BCF (pH 7.4): 46.43; (7)ACD/KOC (pH 5.5): 814.58; (8)ACD/KOC (pH 7.4): 460.32; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.585; (14)Molar Refractivity: 45.88 cm³; (15)Molar Volume: 136.7 cm³; (16)Polarizability: 18.19×10^-24cm³; (17)Surface Tension: 51.6 dyne/cm; (18)Density: 1.703 g/cm³; (19)Flash Point: 129.5 °C; (20)Enthalpy of Vaporization: 55.12 kJ/mol; (21)Boiling Point: 290.6 °C at 760 mmHg; (22)Vapour Pressure: 0.00118 mmHg at 25°C.

Preparation of Ethanone,2-bromo-1-(5-fluoro-2-hydroxyphenyl)-: this chemical can be prepared by 1-(5-fluoro-2-hydroxy-phenyl)-ethanone. This reaction will need reagent bromine and solvents diethyl ether, dioxane. The yield is about 80%.

Ethanone,2-bromo-1-(5-fluoro-2-hydroxyphenyl)- can be prepared by 1-(5-fluoro-2-hydroxy-phenyl)-ethanone

Uses of Ethanone,2-bromo-1-(5-fluoro-2-hydroxyphenyl)-: it can be used to produce a-morpholino-(2-hydroxy-5-fluoro)acetophenone. It will need solvent diethyl ether. The yield is about 56.4%.

Ethanone,2-bromo-1-(5-fluoro-2-hydroxyphenyl)- can be used to produce a-morpholino-(2-hydroxy-5-fluoro)acetophenone

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=C(C=C1F)C(=O)CBr)O
(2)InChI: InChI=1S/C8H6BrFO2/c9-4-8(12)6-3-5(10)1-2-7(6)11/h1-3,11H,4H2
(3)InChIKey: QFYYHGPQMZTLRB-UHFFFAOYSA-N