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CAS No.: | 443-41-4 |
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Name: | 2,6-DIBROMO-4-FLUOROANISOLE |
Molecular Structure: | |
Formula: | C7H5Br2FO |
Molecular Weight: | 283.923 |
Synonyms: | 2,6-Dibromo-4-fluorophenyl methyl ether;1,3-Dibromo-5-fluoro-2-methoxybenzene; |
Density: | 1.892 g/cm3 |
Boiling Point: | 260.1 °C at 760 mmHg |
Flash Point: | 132.1 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36/37/39 |
PSA: | 9.23000 |
LogP: | 3.35930 |
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The Benzene,1,3-dibromo-5-fluoro-2-methoxy-, with the CAS registry number 443-41-4, is also known as 2,6-Dibromo-4-fluorophenyl methyl ether. It belongs to the product categories of Anisole; Anisoles, Alkyloxy Compounds & Phenylacetates; Bromine Compounds; Fluorine Compounds. This chemical's molecular formula is C7H5Br2FO and molecular weight is 283.92. What's more, its IUPAC name is 1,3-dibromo-5-fluoro-2-methoxybenzene.
Physical properties of Benzene,1,3-dibromo-5-fluoro-2-methoxy- are: (1)ACD/LogP: 3.34; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.34; (4)ACD/LogD (pH 7.4): 3.34; (5)ACD/BCF (pH 5.5): 202.37; (6)ACD/BCF (pH 7.4): 202.37; (7)ACD/KOC (pH 5.5): 1557.23; (8)ACD/KOC (pH 7.4): 1557.23; (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: 1.557; (14)Molar Refractivity: 48.3 cm3; (15)Molar Volume: 150 cm3; (16)Polarizability: 19.14×10-24cm3; (17)Surface Tension: 37.8 dyne/cm; (18)Density: 1.892 g/cm3; (19)Flash Point: 132.1 °C; (20)Enthalpy of Vaporization: 47.77 kJ/mol; (21)Boiling Point: 260.1 °C at 760 mmHg; (22)Vapour Pressure: 0.0202 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cc(F)cc(Br)c1OC
(2)Std. InChI: InChI=1S/C7H5Br2FO/c1-11-7-5(8)2-4(10)3-6(7)9/h2-3H,1H3
(3)Std. InChIKey: VFAXMVDRHMXZSH-UHFFFAOYSA-N