3-Bromo-5-fluorobenzylbromide supplier

Name
3-Fluoro-5-bromobenzyl bromide
EINECS
CAS No. 216755-57-6
Article Data8
CAS DataBase
Density 1.923 g/cm³
Solubility Slightly soluble in water (2.9 g/L) (25°C).
Melting Point 47 °C
Formula C₇H₅Br₂F
Boiling Point 251.129 °C at 760 mmHg
Molecular Weight 267.923
Flash Point 105.679 °C
Transport Information
Appearance
Safety 45
Risk Codes 25
Molecular Structure
Hazard Symbols C
Synonyms 3-Bromo-5-fluorobenzyl bromide 98%;
PSA 0.00000
LogP 3.48310

3-Bromo-5-fluorobenzylbromide Specification

The Benzene,1-bromo-3-(bromomethyl)-5-fluoro-, with the CAS registry number of 216755-57-6, is also known as 3-Bromo-5-fluorobenzyl bromide 98%. This chemical's molecular formula is C₇H₅Br₂F and molecular weight is 267.92. What's more, its IUPAC name is 1-Bromo-3-(bromomethyl)-5-fluorobenzene.

Physical properties about the Benzene,1-bromo-3-(bromomethyl)-5-fluoro- are: (1)ACD/LogP: 3.38; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4; (4)ACD/LogD (pH 7.4): 4; (5)ACD/BCF (pH 5.5): 404; (6)ACD/BCF (pH 7.4): 404; (7)ACD/KOC (pH 5.5): 2556; (8)ACD/KOC (pH 7.4): 2556; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 0 Å²; (13)Index of Refraction: 1.583; (14)Molar Refractivity: 46.585 cm³; (15)Molar Volume: 139.32 cm³; (16)Surface Tension: 41.609 dyne/cm; (17)Density: 1.923 g/cm³; (18)Flash Point: 105.679 °C; (19)Enthalpy of Vaporization: 46.867 kJ/mol; (20)Boiling Point: 251.129 °C at 760 mmHg; (21)Vapour Pressure: 0.033 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc1cc(CBr)cc(Br)c1
(2) InChI: InChI=1/C7H5Br2F/c8-4-5-1-6(9)3-7(10)2-5/h1-3H,4H2
(3) InChIKey: DAUWIPUGOIFZNF-UHFFFAOYAH

Product Name

3-Fluoro-5-bromobenzyl bromide

3-Bromo-5-fluorobenzylbromide Specification

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