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HEXADECANE

HEXADECANE


Hexadecane is a straight-chain alkane with 16 carbon atoms. 
Hexadecane is a component of essential oil isolated from long pepper. 
Hexadecane has a role as a plant metabolite, a volatile oil component and a non-polar solvent.

Hexadecane is a flammable saturated hydrocarbon used as the reference material for the cetane number, a measure of the detonation of diesel fuel.


CAS: 544-76-3
European Community (EC) Number: 208-878-9


IUPAC Name: hexadecane

Molecular Formula: C16H34
Molecular Weight: 226.44 g/mol

Hexadecane (also called cetane) is an alkane hydrocarbon with the chemical formula C16H34. 
Hexadecane consists of a chain of 16 carbon atoms, with three hydrogen atoms bonded to the two end carbon atoms, and two hydrogens bonded to each of the 14 other carbon atoms.

Hexadecane is often used as a shorthand for cetane number, a measure of the combustion of diesel fuel.
Hexadecane ignites very easily under compression; for this reason, it is assigned a cetane number of 100, and serves as a reference for other fuel mixtures.

Hexadecyl radical:

Hexadecyl is an alkyl radical of carbon and hydrogen derived from hexadecane, with formula C16H33 and with mass 225.433, occurring especially in cetyl alcohol.
It confers strong hydrophobicity on molecules containing it.
Carboplatin modified with hexadecyl and polyethylene glycol has increased liposolubility and PEGylation, proposed to useful in chemotherapy, specifically non-small-cell lung cancer.

Hexadecyl was used from 1982 for radiolabelling, and this continues to be useful, for example for radiolabelling exosomes and hydrogels, and for positron emission tomography.

Hexadecyl platelet-activating factor has profound effects on the lung, and hexadecyl glyceryl ether participates in the biosynthesis of plasmalogens.

Hexadecane (also called cetane) is an alkane hydrocarbon with the chemical formula C16H34. 
Hexadecane consists of a chain of 16 carbon atoms, with three hydrogen atoms bonded to the two end carbon atoms, and two hydrogens bonded to each of the 14 other carbon atoms.


Hexadecane is an ultra-high purity, straight chain organic solvent suitable for a wide variety of specialized production processes. 
Hexadecane has a very high boiling point and flash point, and is chemically inert. 
Hexadecane is insoluble in water, and demonstrates solubility with other non-polar solvents and organic compounds.

Hexadecane is used in the preparation of emulsions, and as a substrate for the production of biosurfactants. 
Hexadecane is also used in cetane analysis to measure the cetane number of diesel fuel.

Hexadecane is a straight chain, saturated alkane hydrocarbon. 
Hexadecane's research applications include the preparation of emulsions in water, and these have been investigaied by microscopy and NMR.
Oil in water emulsions have been used to investigate such topics as globular protein-oil interactions and the growth of food-borne pathogenic bacteria in liquid culture.
Hexadecane has also been used as a substrate for the bacterial production of biosurfactants.

Hexadecane has been utilized in model studies of the transmembrane domain (TMD) of G protein, as related to the kinetics of poly(ethyleneglycol) (PEG)- mediated fusion of small unilamellar vesicles.

Proteins from wheat seed have been identified as emulsifiers through the use of n-hexadecane.

Hexadecane is use in the recovery of valuable amines by means of distillation from aqueous alkanolamine solutions, which are extensively used in the gas-processing industries.


Hexadecane serves as a reference for other fuel mixtures and is assigned cetane number of 100; used as shorthand for cetane number, an indicator of the combustion speed of diesel fuel. 
Hexadecane is used in the preparation of emulsions; also used as a substrate for the production of biosurfactants. 
Hexadecane has been found useful in the identification of the wheat seed protein CM3 as a highly active emulsifier. 
Superamphiphobicity on polymers can be studied with hexadecane immersion tests. 
Shape-stabilized phase change material (SSPCM), prepared using hexadecane as a PCM, into xGnP as a supporting material, has been demonstrated to have the potential to be used in developing building materials with improved thermal energy storage charecteristics.


Experimental Properties

Physical Description: N-hexadecane is a colorless liquid. 
Color / Form: Colorless liquid
Odor: Odorless (without any specific odor)
Boiling Point: 549 °F at 760 mmHg 
Melting Point: 64.7 °F 
Flash Point: 275 °F
Solubility: In water, 2.1X10-5 mg/L at 25 °C
Density: 0.77331 at 68 °F 
Vapor Density: 7.8
Vapor Pressure: 0.00143 [mmHg]
Autoignition Temperature: 401 °F
Viscosity: 3.474 mPa s at 20 °C
Heat of Combustion: 10040.6 kJ/mol
Heat of Vaporization: 81.35 kJ/mol at 25 °C
Surface Tension: 27.47 nM/m at 25 °C
Refractive Index: 1.4329 at 25 °C


Hexadecane is a component of gasoline, and is used as a solvent, organic intermediate, ignition standard for diesel fuels, and as stock for hydrocracking processes.

- Employed in industry as Adsorbents, Fuels and fuel additives. 
- Also in Fabric, Textile, and Leather Products. 
- Solvent, organic intermediate, ignition standard for diesel fuels. 
- Fuels and Related Products. 

Hexadecane was used as a solvent, a gas chromatography comparison sample, and a standard substance for the determination of diesel combustion quality. 
The cetane number of diesel oil is equal to the body percentage of decabane contained in standard fuel (a mixture of cetane and a-methylnaphthalene) when the combustion quality is the same as that of the diesel under evaluation under specified working conditions. 
Hexadecane is used as a gas chromatography reference substance and a fixed solution and solvent. 
Hexadecane is also used in organic synthesis.
Hexadecane is use in the recovery of valuable amines by means of distillation from aqueous alkanolamine solutions, which are extensively used in the gas-processing industries.

Hexadecane, also known as cetan or CH3-[CH2]14-CH3, is a straight-chain alkane with 16 carbon atoms. 
Hexadecane belongs to the class of organic compounds known as alkanes. 
These are acyclic branched or unbranched hydrocarbons having the general formula CnH2n+2, and consist entirely of hydrogen atoms and saturated carbon atoms. 
Hexadecane is a hydrocarbon lipid molecule that is very hydrophobic, practically insoluble in water, and relatively neutral. 
Hexadecane is an alkane taste. 
Hexadecane is found in highest concentrations in black walnuts. 
Hexadecane has also been detected in allspices, cucumbers, tea, orange bell peppers, and herbs and spices. 
This could make hexadecane a potential biomarker for the consumption of these foods. 


Hexadecane has been used as a phase change material (PCM) in the preparation of hexadecane/xGnP (exfoliated graphite nanoplatelet), a composite PCM loaded with xGnP.

Saturated aliphatic hydrocarbons, such as N-HEXADECANE-D34, may be incompatible with strong oxidizing agents like nitric acid. 
Charring of the hydrocarbon may occur followed by ignition of unreacted hydrocarbon and other nearby combustibles. 
In other settings, aliphatic saturated hydrocarbons are mostly unreactive. 
They are not affected by aqueous solutions of acids, alkalis, most oxidizing agents, and most reducing agents. 
When heated sufficiently or when ignited in the presence of air, oxygen or strong oxidizing agents, they burn exothermically to produce carbon dioxide and water.


Applications
Hexadecane is use in the recovery of valuable amines by means of distillation from aqueous alkanolamine solutions, which are extensively used in the gas-processing industries.

Hexadecane serves as a reference for other fuel mixtures and is assigned cetane number of 100; used as shorthand for cetane number, an indicator of the combustion speed of diesel fuel.
Hexadecane is used in the preparation of emulsions; also used as a substrate for the production of biosurfactants. 
Hexadecane has been found useful in the identification of the wheat seed protein CM3 as a highly active emulsifier. 
Superamphiphobicity on polymers can be studied with hexadecane immersion tests. 
Shape-stabilized phase change material (SSPCM), prepared using hexadecane as a PCM, into xGnP as a supporting material, has been demonstrated to have the potential to be used in developing building materials with improved thermal energy storage charecteristics.


SYNONYMS:

HEXADECANE
n-Hexadecane
544-76-3
Cetane
n-Cetane
Hexadekan
Cetan
Zetan
CCRIS 5833
HSDB 6854
F8Z00SHP6Q
NSC 7334
EINECS 208-878-9
BRN 1736592
AI3-06522
UNII-F8Z00SHP6Q
MFCD00008998
DTXSID0027195
CHEBI:45296
HEXADECANE, N-
NSC-7334
PARAFOL 16-97
DTXCID607195
Hexadecane-1-D 98 atom % d
EC 208-878-9
4-01-00-00537 (Beilstein Handbook Reference)
hexadecan
Pentadecane, methyl-
Hexadecane, analytical standard
CH3-(CH2)14-CH3
CH3-[CH2]14-CH3
CNS
Hexadecane; Cetane; NSC 7334; S 6 (alkane); n-Cetane; n-Hexadecane
Hexadecane solution
Hexadecane, >=99%
HEXADECANE [HSDB]
HEXADECANE [INCI]
Hexadecane, p.a., 99%
UNII: F8Z00SHP6Q
Hexadecane_RamanathanGurudeeban
CHEMBL134994
QSPL 025
QSPL 078
QSPL 116
Hexadecane, anhydrous, >=99%
NSC7334
Hexadecane, ReagentPlus(R), 99%
Tox21_300485
LMFA11000577
AKOS025212855
n-Hexadecane 10 microg/mL in Acetone
Hexadecane, purum, >=98.0% (GC)
NCGC00164132-01
NCGC00164132-02
NCGC00254306-01
AS-56424
CAS-544-76-3
SY010655
Hexadecane, Vetec(TM) reagent grade, 98%
CS-0152222
FT-0632360
H0066
NS00009955
S0288
D97389
A830206
Q150843
5166841B-BF92-4A7D-8CEF-0B01B374ED0E
InChI=1/C16H34/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3-16H2,1-2H

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