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Benzene,4-(2-bromoethoxy)-1,2-dichloro- (3245-41-8)

Identification
Name:Benzene,4-(2-bromoethoxy)-1,2-dichloro-
Synonyms:Phenetole, b-bromo-3,4-dichloro-(7CI,8CI);1-Bromo-2-(3,4-dichlorophenoxy)ethane;2-(3,4-Dichlorophenoxy)ethylbromide;NSC 132956;b-(3,4-Dichlorophenoxy)ethylbromide;
CAS:3245-41-8
Molecular Formula: C8H7BrCl2O
Molecular Weight: 269.95
InChI: InChI=1/C8H7BrCl2O/c9-3-4-12-6-1-2-7(10)8(11)5-6/h1-2,5H,3-4H2
Molecular Structure: (C8H7BrCl2O) Phenetole, b-bromo-3,4-dichloro-(7CI,8CI);1-Bromo-2-(3,4-dichlorophenoxy)ethane;2-(3,4-Dichloropheno...
Properties
Flash Point: 143.4°C
Boiling Point: 313.5°Cat760mmHg
Density:1.616g/cm3
Refractive index:1.573
Specification:

The 4-(2-Bromoethoxy)-1,2-dichlorobenzene, with CAS registry number of 3245-41-8,  has the systematic name of 2-bromoethyl 3,4-dichlorophenyl ether. And its IUPAC name is 4-(2-bromoethoxy)-1,2-dichlorobenzene. Besides this, it is also named benzene, 4-(2-bromoethoxy)-1,2-dichloro-.

Physical properties about this chemical are: (1)ACD/LogP: 4.29; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 9.23 Å2; (7)Index of Refraction: 1.573; (8)Molar Refractivity: 55.08 cm3; (9)Molar Volume: 167 cm3; (10)Polarizability: 21.83×10-24cm3; (11)Surface Tension: 42.9 dyne/cm; (12)Enthalpy of Vaporization: 53.25 kJ/mol; (13)Vapour Pressure: 0.000908 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(OCCBr)cc1Cl
(2)InChI: InChI=1/C8H7BrCl2O/c9-3-4-12-6-1-2-7(10)8(11)5-6/h1-2,5H,3-4H2
(3)InChIKey: SQMJIYQANBYVEL-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C8H7BrCl2O/c9-3-4-12-6-1-2-7(10)8(11)5-6/h1-2,5H,3-4H2
(5)Std. InChIKey: SQMJIYQANBYVEL-UHFFFAOYSA-N

Flash Point: 143.4°C
Safety Data
 

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