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112-95-8

Basic Information
CAS No.: 112-95-8
Name: N-EICOSANE
Article Data: 61
Molecular Structure:
Molecular Structure of 112-95-8 (N-EICOSANE)
Formula: C20H42
Molecular Weight: 282.553
Synonyms: Eicosane-4-C12;NSC 62789;n-Eicosane;
EINECS: 204-018-1
Density: 0.787 g/cm3
Melting Point: 35-37 °C(lit.)
Boiling Point: 343.4 °C at 760 mmHg
Flash Point: 186.5 °C
Solubility: Soluble in ether, petroleum ether and benzene. Slightly soluble in acetone and chloroform. Insoluble in water.
Appearance: Colourless crystals or wax-like solid
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 24/25-36/37-26
PSA: 0.00000
LogP: 8.04800
Synthetic route
3452-07-1

1-Eicosene

112-95-8

icosane

Conditions
ConditionsYield
With hydrogen; TMSB; palladium In ethanol at 20℃; under 760 Torr; for 16h;98%
2050-77-3

Iododecane

A

124-18-5

decane

B

112-95-8

icosane

Conditions
ConditionsYield
With tetrabutylammonium tetrafluoroborate In N,N-dimethyl-formamide Electrochemical reaction; Inert atmosphere;A 1%
B 97%
With sodium polystyrylanthracene Product distribution;A 25%
B 4%
112-29-8

1-bromo dodecane

112-95-8

icosane

Conditions
ConditionsYield
With pyridine; manganese; trifluoroacetic acid; cobalt(II) bromide In acetonitrile at 50℃;87%
17049-50-2

n-decyl magnesium bromide

13134-23-1

benzophenone N-methyl-N,N-pentane-1,5-diylhydrazonium iodide

A

626-67-5

N-methylcyclohexylamine

B

1013-88-3

Benzophenone imine

C

124-18-5

decane

D

112-95-8

icosane

E

872-05-9

1-Decene

Conditions
ConditionsYield
In diethyl ether Product distribution; Mechanism; Heating; other quaternary hydrazonium salts, other alkylmagnesium halides;A 85%
B 84%
C 51%
D 21%
E 25%
30089-00-0

9-octyl-9-bora-bicyclo[3.3.1]nonane

112-52-7

1-chlorododecane

112-95-8

icosane

Conditions
ConditionsYield
With cesium hydroxide; tris(dibenzylideneacetone)dipalladium (0); tricyclohexylphosphine In 1,4-dioxane at 90℃; for 48h; Suzuki cross-coupling;83%
30089-00-0

9-octyl-9-bora-bicyclo[3.3.1]nonane

10157-76-3

dodecyl 4-methylbenzenesulphonate

112-95-8

icosane

Conditions
ConditionsYield
With palladium diacetate; sodium hydroxide; di-tert-butyl(methyl)phosphonium tetrafluoroborate salt In 1,4-dioxane at 50℃; Product distribution; Further Variations:; Reagents; Temperatures; reaction times; Suzuki cross-coupling;82%
With copper(l) iodide; lithium tert-butoxide In N,N-dimethyl-formamide at 80℃; for 24h; Suzuki-Miyauri coupling; Inert atmosphere;64%
112-29-8

1-bromo dodecane

A

112-95-8

icosane

B

112-30-1

1-Decanol

Conditions
ConditionsYield
Stage #1: 1-bromo dodecane With magnesium In tetrahydrofuran Grignard Reaction; Inert atmosphere; Reflux;
Stage #2: With dilithium tetrachlorocuprate(II); oxygen In tetrahydrofuran at 20℃; for 2h;
A 60%
B 36%
30089-00-0

9-octyl-9-bora-bicyclo[3.3.1]nonane

51323-71-8

dodecyl mesylate

112-95-8

icosane

Conditions
ConditionsYield
With palladium diacetate; sodium hydroxide; methyldi-t-butylphosphine In 1,4-dioxane at 50℃; Suzuki cross-coupling;51%
24767-82-6

1-heptyl 4-methylbenzenesulfonate

677-22-5

tert-butylmagnesium chloride

A

124-18-5

decane

B

112-95-8

icosane

C

17302-14-6

2,2-dimethylnonane

Conditions
ConditionsYield
With CuBr*Me2S-LiBr; lithium thiophenoxide In tetrahydrofuran; N,N,N,N,N,N-hexamethylphosphoric triamide at 67℃; for 24h; further reagents;A n/a
B n/a
C 50%
112-29-8

1-bromo dodecane

A

124-18-5

decane

B

112-95-8

icosane

Conditions
ConditionsYield
With hydrogenchloride; sodium peroxide; magnesium 1.) 22 deg C, 30 min, diethyl ether; Multistep reaction;A n/a
B 25%
With hydrogenchloride; sodium peroxide; magnesium 1.) 22 deg C, 30 min, diethyl ether; Yield given. Multistep reaction;
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Chemistry

IUPAC Name: Icosane
Synonyms: Eicosan ; Didecyl ; LFA ; Lipid fragment
Product Categories: Analytical Chemistry;n-Paraffins (GC Standard);Standard Materials for GC;Alpha Sort;EA - EO;E-LAlphabetic;Volatiles/ Semivolatiles;Acyclic;Alkanes;Organic Building Blocks;EA - EOChemical Class;Alphabetic;E;Hydrocarbons;Neats
CAS NO: 112-95-8
Molecular Formula of N-Eicosane (CAS NO.112-95-8) : C20H42
Molecular Weight  of N-Eicosane (CAS NO.112-95-8) :282.55
Molecular Structure  of N-Eicosane (CAS NO.112-95-8) :
EINECS: 204-018-1
Index of Refraction: 1.44
Surface Tension: 28.3 dyne/cm
Density: 0.787 g/cm3
Flash Point: 186.5 °C
Enthalpy of Vaporization: 56.4 kJ/mol
Boiling Point: 343.4 °C at 760 mmHg
Vapour Pressure: 0.00014 mmHg at 25°C
Melting point: 35-37 °C(lit.)
Stability: Stable. Combustible. Incompatible with strong oxidizing agents.
Appearance:Colorless crystals or white crystalline solid.
Air & Water Reactions :Insoluble in water.

Uses

For special surfactants and the preparation of certain organic chemicals, also used for chromatographic analysis reference material. Gas chromatography stationary phase

Safety Profile

Hazard Codes IrritantXi
Risk Statements 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements 24/25-36/37-26
S24/25:Avoid contact with skin and eyes. 
S36/37:Wear suitable protective clothing and gloves. 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
WGK Germany 3

Specification

1.Reactivity Profile: Saturated aliphatic hydrocarbons, such as N-EICOSANE, 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.
2.Fire Hazard : N-Eicosane is combustible.