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CAS No.: | 6954-77-4 |
---|---|
Name: | 1-(2-Bromoethoxy)-2,4-dichlorobenzene |
Article Data: | 16 |
Molecular Structure: | |
Formula: | C8H7BrCl2O |
Molecular Weight: | 269.953 |
Synonyms: | b-Bromo-2,4-dichlorophenetole;Beta-bromo-2,4-dichlorophenetole;Benzene, 1-(2-bromoethoxy)-2,4-dichloro-; |
Density: | 1.616 g/cm3 |
Boiling Point: | 308.6 °C at 760 mmHg |
Flash Point: | 140.5 °C |
Hazard Symbols: | Xi,Xn |
Risk Codes: | 36/37/38-20/22 |
Safety: | 37/39-26 |
PSA: | 9.23000 |
LogP: | 3.76710 |
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The CAS register number of 1-(2-Bromoethoxy)-2,4-dichlorobenzene is 6954-77-4. It also can be called as Benzene, 1-(2-bromoethoxy)-2,4-dichloro- and the IUPAC name about this chemical is 1-(2-bromoethoxy)-2,4-dichlorobenzene. The molecular formula about this chemical is C8H7BrCl2O and the molecular weight is 269.95. It belongs to the Phenetole.
Physical properties about 1-(2-Bromoethoxy)-2,4-dichlorobenzene are: (1)ACD/LogP: 4.14; (2)ACD/LogD (pH 5.5): 4.14; (3)ACD/LogD (pH 7.4): 4.14; (4)ACD/BCF (pH 5.5): 828.46; (5)ACD/BCF (pH 7.4): 828.46; (6)ACD/KOC (pH 5.5): 4270.71; (7)ACD/KOC (pH 7.4): 4270.71; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 9.23Å2; (11)Index of Refraction: 1.573; (12)Molar Refractivity: 55.08 cm3; (13)Molar Volume: 167 cm3; (14)Polarizability: 21.83x10-24cm3; (15)Surface Tension: 42.9 dyne/cm; (16)Enthalpy of Vaporization: 52.74 kJ/mol; (17)Boiling Point: 308.6 °C at 760 mmHg; (18)Vapour Pressure: 0.00122 mmHg at 25°C.
Preparation: this chemical can be prepared by 1,2-dibromo-ethane and 2,4-dichloro-pheno. This reaction will need reagent aq. NaOH.
When you are using this chemical, please be cautious about it as the following:
This chemical is harmful by inhalation and if swallowed, and also it is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(Cl)ccc1OCCBr
(2)InChI: InChI=1/C8H7BrCl2O/c9-3-4-12-8-2-1-6(10)5-7(8)11/h1-2,5H,3-4H2
(3)InChIKey: OEYZGSRLAGSENP-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C8H7BrCl2O/c9-3-4-12-8-2-1-6(10)5-7(8)11/h1-2,5H,3-4H2
(5)Std. InChIKey: OEYZGSRLAGSENP-UHFFFAOYSA-N