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HomeProduct name list1-Bromohexadecane

1-Bromohexadecane

Synonym(s):Cetyl bromide;Hexadecyl bromide

  • CAS NO.:112-82-3
  • Empirical Formula: C16H33Br
  • Molecular Weight: 305.34
  • MDL number: MFCD00000230
  • EINECS: 204-008-7
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2024-11-07 13:31:19
1-Bromohexadecane Structural

What is 1-Bromohexadecane?

Chemical properties

colourless to yellow liquid or solid.soluble in ether, alcohol, insoluble in water.

The Uses of 1-Bromohexadecane

1-Bromohexadecane has been used:
in the preparation of soluble carbon nano-onions by covalent functionalization with hexadecyl chains
as extraction solvent in determination of endocrine-disrupting phenols (EDPs) in water samples by ultrasound-assisted emulsification microextraction (MS-USAEME) method
in the preparation of [2-(methacryloyloxy)ethyl]dimethylhexadecylammonium bromide monomer, required for the synthesis of novel methacrylate based adsorbents
in the synthesis of surfactant, N-hexadecyl ethylenediamine triacetic acid (HED3A)

The Uses of 1-Bromohexadecane

1-Bromohexadecane is used in the preparation of soluble carbon nano-onions by covalent functionalization with hexadecyl chains. It is also used to synthesize [2-(methacryloyloxy)ethyl]dimethylhexadecylammonium bromide monomer, required for the synthesis of novel methacrylate based adsorbents.

Preparation

Synthesis of 1-Bromohexadecane from hexadecanol by bromination: put hexadecanol into the reaction pot and stir, heat, melt and put in red phosphorus. Add bromine drop by drop at 100℃ with sufficient stirring on one side, control 120-130℃, about 6h drop by drop, continue the reaction and drain the hydrogen bromide. Cool to below 50 ℃, add saturated and sodium chloride, stirring and washing, resting stratification, parting off the lower waste stream, then wash with water to neutral, distillation, collect 220-230 ℃ (2kPa) fraction, to obtain 1-bromohexadecane.

Purification Methods

Shake the bromide with H2SO4, wash with H2O, dry with K2CO3 and fractionally distil it in vacuo.[Beilstein 1 IV 542.]

Properties of 1-Bromohexadecane

Melting point: 16-18 °C(lit.)
Boiling point: 190 °C11 mm Hg(lit.)
Density  0.999 g/mL at 25 °C(lit.)
vapor density  10.6 (vs air)
vapor pressure  <1 mm Hg ( 20 °C)
refractive index  n20/D 1.4609(lit.)
Flash point: >230 °F
storage temp.  Inert atmosphere,Room Temperature
solubility  Difficult to mix.
form  Liquid After Melting
color  Clear amber to brown-black
Specific Gravity 1.000 (20/4℃)
Water Solubility  INSOLUBLE
BRN  773989
Dielectric constant 3.71
Stability: Stable. Incompatible with strong oxidizing agents. Combustible.
CAS DataBase Reference 112-82-3(CAS DataBase Reference)
NIST Chemistry Reference Hexadecane, 1-bromo-(112-82-3)
EPA Substance Registry System Hexadecane, 1-bromo- (112-82-3)

Safety information for 1-Bromohexadecane

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
Precautionary Statement Codes P302+P352:IF ON SKIN: wash with plenty of soap and water.

Computed Descriptors for 1-Bromohexadecane

InChIKey HNTGIJLWHDPAFN-UHFFFAOYSA-N

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