2-Bromo-3-fluoronitrobenzene supplier

Name
2-Bromo-3-fluoronitrobenzene
EINECS 1533716-785-6
CAS No. 59255-94-6
Article Data7
CAS DataBase
Density 1.808 g/cm³
Solubility
Melting Point 42.0-44.0 °C(Solv: ethyl acetate (141-78-6); hexane (110-54-3))
Formula C₆H₃BrFNO₂
Boiling Point 222.326 °C at 760 mmHg
Molecular Weight 219.998
Flash Point 88.26 °C
Transport Information
Appearance
Safety
Risk Codes T:;
Molecular Structure
Hazard Symbols T
Synonyms 2-Brom-1-fluor-3-nitrobenzol;2-Bromo-1-fluoro-3-nitrobenzene;
PSA 45.82000
LogP 3.01960

2-Bromo-3-fluoronitrobenzene Specification

The CAS register number of 2-Bromo-3-fluoronitrobenzene is 59255-94-6. It also can be called as Benzene, 2-bromo-1-fluoro-3-nitro- and the systematic name about this chemical is 2-bromo-1-fluoro-3-nitrobenzene. The molecular formula about this chemical is C₆H₃BrFNO₂and the molecular weight is 220.00. It belongs to the following product categories, such as Blocks; Bromides; FluoroCompounds; NitroCompounds and so on.

Physical properties about 2-Bromo-3-fluoronitrobenzene are: (1)ACD/LogP: 2.39; (2)ACD/LogD (pH 5.5): 2.38; (3)ACD/LogD (pH 7.4): 2.38; (4)ACD/BCF (pH 5.5): 38.23; (5)ACD/BCF (pH 7.4): 38.23; (6)ACD/KOC (pH 5.5): 472.37; (7)ACD/KOC (pH 7.4): 472.37; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 45.82Å²; (11)Index of Refraction: 1.579; (12)Molar Refractivity: 40.48 cm³; (13)Molar Volume: 121.6 cm³; (14)Polarizability: 16.04x10^-24cm³; (15)Surface Tension: 48 dyne/cm; (16)Enthalpy of Vaporization: 44.01 kJ/mol; (17)Boiling Point: 222.3 °C at 760 mmHg; (18)Vapour Pressure: 0.152 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cccc(N(=O)=O)c1Br
(2)InChI: InChI=1/C6H3BrFNO2/c7-6-4(8)2-1-3-5(6)9(10)11/h1-3H
(3)InChIKey: ICIVWQQTOYDXDM-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C6H3BrFNO2/c7-6-4(8)2-1-3-5(6)9(10)11/h1-3H
(5)Std. InChIKey: ICIVWQQTOYDXDM-UHFFFAOYSA-N

Product Name

2-Bromo-3-fluoronitrobenzene

2-Bromo-3-fluoronitrobenzene Specification

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