(1-Bromoethyl)benzene supplier

Name
(1-Bromoethyl)benzene
EINECS 209-560-2
CAS No. 585-71-7
Article Data176
CAS DataBase
Density 1.356
Solubility
Melting Point 1.358 g/cm³
Formula C₈H₉Br
Boiling Point 203 °C at 760 mmHg
Molecular Weight 185.063
Flash Point 80.2 °C
Transport Information
Appearance clear yellow to brownish liquid
Safety 26-24/25
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms (1-Bromoethyl)benzene;(?à)-(1-Bromoethyl)benzene;(?à)-1-Bromo-1-phenylethane;(?à)-1-Phenylethyl bromide;(a-Bromoethyl)benzene;1-(1-Bromoethyl)benzene;1-Bromo-1-phenylethane;1-Phenethyl bromide;1-Phenyl-1-bromoethane;1-Phenylbromoethane;1-Phenylethyl bromide;NSC 8052;a-Methylbenzyl bromide;a-Phenethyl bromide;a-Phenylethyl bromide;
PSA 0.00000
LogP 3.14250

(1-Bromoethyl)benzene Specification

The Benzene,(1-bromoethyl)-, with CAS registry number 585-71-7, belongs to the following product category: Benzene derivates. It has the systematic name of 1-bromoethylbenzene. This chemical is a kind of clear yellow to brownish liquid. And it should be stored in the refrigerator. What's more, its EINECS is 209-560-2.

Physical properties of Benzene,(1-bromoethyl)-: (1)ACD/LogP: 3.27; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.27; (4)ACD/LogD (pH 7.4): 3.27; (5)#H bond acceptors: 0; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 1; (8)Index of Refraction: 1.552; (9)Molar Refractivity: 43.53 cm³; (10)Molar Volume: 136.1 cm³; (11)Polarizability: 17.25×10^-24cm³; (12)Surface Tension: 36.4 dyne/cm; (13)Density: 1.358 g/cm³; (14)Flash Point: 80.2 °C; (15)Enthalpy of Vaporization: 42.13 kJ/mol; (16)Boiling Point: 203 °C at 760 mmHg; (17)Vapour Pressure: 0.405 mmHg at 25°C.

Preparation: this chemical can be prepared by vinylbenzene. This reaction will need reagent hydrobromic acid.

Uses of Benzene,(1-bromoethyl)-: it can be used to produce 2,3-diphenyl-butane. This reaction will need reagents Mn₂(CO)₁₀, aq. sodium hydroξde, BTAC and solvent CH₂Cl₂. The yield is about 75%.

When you are using this chemical, please be cautious about it as the following:
The Benzene,(1-bromoethyl)- irritates to eyes, respiratory system and skin. When use this chemical, avoid contact with skin and eyes. 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: BrC(C)c1ccccc1
(2)InChI: InChI=1/C8H9Br/c1-7(9)8-5-3-2-4-6-8/h2-7H,1H3
(3)InChIKey: CRRUGYDDEMGVDY-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C8H9Br/c1-7(9)8-5-3-2-4-6-8/h2-7H,1H3
(5)Std. InChIKey: CRRUGYDDEMGVDY-UHFFFAOYSA-N

Product Name

(1-Bromoethyl)benzene

(1-Bromoethyl)benzene Specification

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