4-Chloro-2,6-difluorobenzyl bromide supplier

Name
4-Chloro-2,6-difluorobenzyl bromide
EINECS
CAS No. 537013-52-8
Density 1.733 g/cm³
Solubility Insoluble in water.
Melting Point
Formula C₇H₄BrClF₂
Boiling Point 210.7 °C at 760 mmHg
Molecular Weight 241.46
Flash Point 81.2 °C
Transport Information
Appearance
Safety
Risk Codes 22
Molecular Structure
Hazard Symbols Xi
Synonyms 4-CHLORO-2,6-DIFLUOROBENZYL BROMIDE;2-(Bromomethyl)-5-chloro-1,3-difluorobenzene
PSA 0.00000
LogP 3.51310

4-Chloro-2,6-difluorobenzyl bromide Specification

This chemical is called 4-Chloro-2,6-difluorobenzyl bromide, and its systematic name is 2-(bromomethyl)-5-chloro-1,3-difluorobenzene. With the molecular formula of C₇H₄BrClF₂, its molecular weight is 241.46. The CAS registry number of this chemical is 537013-52-8.

Other characteristics of the 4-Chloro-2,6-difluorobenzyl bromide can be summarised as followings: (1)ACD/LogP: 2.77; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.77; (4)ACD/LogD (pH 7.4): 2.77; (5)ACD/BCF (pH 5.5): 75.37; (6)ACD/BCF (pH 7.4): 75.37; (7)ACD/KOC (pH 5.5): 767.94; (8)ACD/KOC (pH 7.4): 767.94; (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: 1.541; (14)Molar Refractivity: 43.78 cm³; (15)Molar Volume: 139.2 cm³; (16)Polarizability: 17.35×10^-24cm³; (17)Surface Tension: 38.2 dyne/cm; (18)Density: 1.733 g/cm³; (19)Flash Point: 81.2 °C; (20)Enthalpy of Vaporization: 42.87 kJ/mol; (21)Boiling Point: 210.7 °C at 760 mmHg; (22)Vapour Pressure: 0.276 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Fc1c(c(F)cc(Cl)c1)CBr
2.InChI: InChI=1/C7H4BrClF2/c8-3-5-6(10)1-4(9)2-7(5)11/h1-2H,3H2
3.InChIKey: KYKUEAHGMDKVLF-UHFFFAOYAQ
4.Std. InChI: InChI=1S/C7H4BrClF2/c8-3-5-6(10)1-4(9)2-7(5)11/h1-2H,3H2
5.Std. InChIKey: KYKUEAHGMDKVLF-UHFFFAOYSA-N

Product Name

4-Chloro-2,6-difluorobenzyl bromide

4-Chloro-2,6-difluorobenzyl bromide Specification

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