Benzene, 4-bromo-1-chloro-2-ethyl- supplier

Name
4-BROMO-1-CHLORO-2-ETHYLBENZENE
EINECS
CAS No. 289039-22-1
Article Data2
CAS DataBase
Density 1.459 g/cm³
Solubility
Melting Point
Formula C₈H₈BrCl
Boiling Point 235.1 °C at 760 mmHg
Molecular Weight 219.509
Flash Point 116.2 °C
Transport Information
Appearance colorless liquid
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 4-Bromo-1-chloro-2-ethylbenzene;5-Bromo-2-chloroethylbenzene;
PSA 0.00000
LogP 3.66490

Benzene, 4-bromo-1-chloro-2-ethyl- Specification

The Benzene, 4-bromo-1-chloro-2-ethyl-, with the CAS registry number 289039-22-1, is also known as 5-Bromo-2-chloroethylbenzene. It belongs to the product categories of Bromine Compounds; Chlorine Compounds. This chemical's molecular formula is C₈H₈BrCl and molecular weight is 219.51. What's more, its systematic name is 4-bromo-1-chloro-2-ethylbenzene. It should be sealed and stored in a cool, ventilated and dry place. Moreover, it should be protected from oxides.

Physical properties of Benzene, 4-bromo-1-chloro-2-ethyl- are: (1)ACD/LogP: 4.52; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.51; (4)ACD/LogD (pH 7.4): 4.51; (5)#H bond acceptors: 0; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 1; (8)Index of Refraction: 1.556; (9)Molar Refractivity: 48.38 cm³; (10)Molar Volume: 150.3 cm³; (11)Polarizability: 19.18×10^-24cm³; (12)Surface Tension: 36.7 dyne/cm; (13)Density: 1.459 g/cm³; (14)Flash Point: 116.2 °C; (15)Enthalpy of Vaporization: 45.28 kJ/mol; (16)Boiling Point: 235.1 °C at 760 mmHg; (17)Vapour Pressure: 0.0778 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCC1=C(C=CC(=C1)Br)Cl
(2)InChI: InChI=1S/C8H8BrCl/c1-2-6-5-7(9)3-4-8(6)10/h3-5H,2H2,1H3
(3)InChIKey: ILQNJGBEXZUYOI-UHFFFAOYSA-N

Product Name

4-BROMO-1-CHLORO-2-ETHYLBENZENE

Benzene, 4-bromo-1-chloro-2-ethyl- Specification

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