Name: Benzene, 1,4-bis(3-bromopropyl)-
SKU: 19417-59-5

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Basic Information

Molecular Structure:
CAS No.:	19417-59-5
Name:	Benzene, 1,4-bis(3-bromopropyl)-
Article Data:	6

Formula:	C₁₂H₁₆Br₂
Molecular Weight:	320.067
Synonyms:	1,4-Bis-(3-bromo-propyl)-benzene;
Density:	1.492 g/cm³
Boiling Point:	327.2 °C at 760 mmHg
Flash Point:	175.7 °C

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Specification

The Benzene, 1,4-bis(3-bromopropyl)- has the CAS registry number 19417-59-5. This chemical's molecular formula is C₁₂H₁₆Br₂ and molecular weight is 320.06. What's more, its systematic name is 1,4-bis(3-bromopropyl)benzene.

Physical properties of Benzene, 1,4-bis(3-bromopropyl)- are: (1)ACD/LogP: 5.22; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.22; (4)ACD/LogD (pH 7.4): 5.22; (5)ACD/BCF (pH 5.5): 5457.86; (6)ACD/BCF (pH 7.4): 5457.86; (7)ACD/KOC (pH 5.5): 16464.66; (8)ACD/KOC (pH 7.4): 16464.66; (9)Index of Refraction: 1.567; (10)Molar Refractivity: 70.08 cm³; (11)Molar Volume: 214.4 cm³; (12)Polarizability: 27.78×10^-24cm³; (13)Surface Tension: 41.5 dyne/cm; (14)Density: 1.492 g/cm³; (15)Flash Point: 175.7 °C; (16)Enthalpy of Vaporization: 54.69 kJ/mol; (17)Boiling Point: 327.2 °C at 760 mmHg; (18)Vapour Pressure: 0.000391 mmHg at 25°C.

Uses of Benzene, 1,4-bis(3-bromopropyl)-: it can be used to produce 1,4-bis[3-(2-formylphenoxy)propyl]benzene by heating. It will need reagent potassium hydroxide and solvent ethanol. The yield is about 78.1%.

Benzene, 1,4-bis(3-bromopropyl)- can be used to produce 1,4-bis[3-(2-formylphenoxy)propyl]benzene by heating

You can still convert the following datas into molecular structure:
(1)SMILES: BrCCCc1ccc(CCCBr)cc1
(2)InChI: InChI=1S/C12H16Br2/c13-9-1-3-11-5-7-12(8-6-11)4-2-10-14/h5-8H,1-4,9-10H2
(3)InChIKey: JMDJLONNYRBOTA-UHFFFAOYSA-N