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