2-Bromo-6-fluoroanisole supplier

Name
2-Bromo-6-fluoroanisole
EINECS 679-553-0
CAS No. 845829-94-9
Article Data9
CAS DataBase
Density 1.532 g/cm³
Solubility
Melting Point
Formula C₇H₆BrFO
Boiling Point 208.587 °C at 760 mmHg
Molecular Weight 205.026
Flash Point 94.379 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 1-Bromo-3-fluoro-2-methoxybenzene;2-Bromo-6-fluorophenyl methyl ether;3-Bromo-1-fluoro-2-methoxybenzene;
PSA 9.23000
LogP 2.59680

2-Bromo-6-fluoroanisole Specification

The Benzene,1-bromo-3-fluoro-2-methoxy-, with the CAS registry number 845829-94-9, is also known as 2-Bromo-6-fluorophenyl methyl ether. It belongs to the product categories of Benzene series; Benzenes. This chemical's molecular formula is C₇H₆BrFO and molecular weight is 205.02. What's more, its systematic name is 1-Bromo-3-fluoro-2-methoxybenzene.

Physical properties of Benzene,1-bromo-3-fluoro-2-methoxy- are: (1)ACD/LogP: 2.697; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.70; (4)ACD/LogD (pH 7.4): 2.70; (5)ACD/BCF (pH 5.5): 66.05; (6)ACD/BCF (pH 7.4): 66.05; (7)ACD/KOC (pH 5.5): 698.69; (8)ACD/KOC (pH 7.4): 698.69; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.518; (14)Molar Refractivity: 40.615 cm³; (15)Molar Volume: 133.83 cm³; (16)Polarizability: 16.101×10^-24cm³; (17)Surface Tension: 33.33 dyne/cm; (18)Density: 1.532 g/cm³; (19)Flash Point: 94.379 °C; (20)Enthalpy of Vaporization: 42.67 kJ/mol; (21)Boiling Point: 208.587 °C at 760 mmHg; (22)Vapour Pressure: 0.31 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: COc1c(F)cccc1Br
(2)Std. InChI: InChI=1S/C7H6BrFO/c1-10-7-5(8)3-2-4-6(7)9/h2-4H,1H3
(3)Std. InChIKey: RLSQPLJXDTXSCL-UHFFFAOYSA-N

Product Name

2-Bromo-6-fluoroanisole

2-Bromo-6-fluoroanisole Specification

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