CAS No.7497-87-2,1-(3-BROMOPROPOXY)-4-BROMOBENZENE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	7497-87-2
Name:	1-(3-BROMOPROPOXY)-4-BROMOBENZENE
Article Data:	23

Formula:	C₉H₁₀Br₂O
Molecular Weight:	293.986
Synonyms:	1-Bromo-3-(4-bromophenoxy)propane;3-(4-Bromophenoxy)propyl bromide;4-Bromophenyl 3-bromopropyl ether;NSC 406842;
Density:	1.672 g/cm³
Boiling Point:	324.1 °C at 760 mmHg
Flash Point:	131.2 °C
PSA:	9.23000
LogP:	3.61290

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Specification

The Benzene, 1-bromo-4-(3-bromopropoxy)-, with the CAS registry number 7497-87-2, is also known as 1-Bromo-3-(4-bromophenoxy)propane. This chemical's molecular formula is C₉H₁₀Br₂O and molecular weight is 293.9831. What's more, its IUPAC name is 1-Bromo-4-(3-bromopropoxy)benzene.

Physical properties about Benzene, 1-bromo-4-(3-bromopropoxy)- are: (1)ACD/LogP: 4.32; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 9.23 Å²; (7)Index of Refraction: 1.569; (8)Molar Refractivity: 57.61 cm³; (9)Molar Volume: 175.8 cm³; (10)Polarizability: 22.84×10^-24 cm³; (11)Surface Tension: 41.4 dyne/cm; (12)Density: 1.672 g/cm³; (13)Flash Point: 131.2 °C; (14)Enthalpy of Vaporization: 54.36 kJ/mol; (15)Boiling Point: 324.1 °C at 760 mmHg; (16)Vapour Pressure: 0.000474 mmHg at 25 °C.

Preparation of Benzene, 1-bromo-4-(3-bromopropoxy)-: this chemical is prepared by reaction of 4-Bromo-phenol with 1, 3-Dibromo-propane. The reaction needs reagent K₂CO₃ and solvent Acetonitrile. The yield is about 80 %.

The Benzene, 1-bromo-4-(3-bromopropoxy)- can be obtained by 4-Bromo-phenol and 1, 3-Dibromo-propane.

Uses of Benzene, 1-bromo-4-(3-bromopropoxy)-: it is used to produce other chemicals. For example, it is used to produce [3-(4-Bromo-phenoxy)-propyl]-dimethyl-amine. This reaction needs reagents TEA and AgOTs. Meanwhile, it needs solvent CH₂Cl₂. The yield is about 91 %.

Benzene, 1-bromo-4-(3-bromopropoxy)- can react with Dimethylamine to get [3-(4-Bromo-phenoxy)-propyl]-dimethyl-amine.

You can still convert the following datas into molecular structure:
(1) SMILES: Brc1ccc(OCCCBr)cc1
(2) InChI: InChI=1/C9H10Br2O/c10-6-1-7-12-9-4-2-8(11)3-5-9/h2-5H,1,6-7H2
(3) InChIKey: SBXHUNUKIBIOEC-UHFFFAOYAU