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Tri-n-hexylaluminium

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Name

Tri-n-hexylaluminium

EINECS 214-241-6
CAS No. 1116-73-0 Density g/cm3
PSA 0.00000 LogP 7.60290
Solubility N/A Melting Point -87oC
Formula C18H39 Al Boiling Point 68.5 °C at 760 mmHg
Molecular Weight 282.489 Flash Point °C
Transport Information N/A Appearance clear colorless solution
Safety 6A-61-45-43B-36/37/39-24/25-16 Risk Codes 67-65-62-51/53-48/20-34-14/15-11
Molecular Structure Molecular Structure of 1116-73-0 (TRI-N-HEXYL ALUMINUM) Hazard Symbols DangerousNCorrosiveCFlammableF
Synonyms

Tri-n-hexylaluminum;Tri-n-hexylaluminum (Al(C6H13)3); Trihexylalane; Trihexylaluminum

Article Data 13

Tri-n-hexylaluminium Synthetic route

16853-85-3

lithium aluminium tetrahydride

592-41-6

1-hexene

2674-15-9

di(n-hexyl)aluminum chloride

1116-73-0

trihexylaluminium

Conditions
ConditionsYield
In n-heptane byproducts: LiCl; LiAlH4 loaded in a vertical-type ball mill under Ar or N2; heptane added; mixt. agitated for 15 min at 70°C; mixt. of (C6H13)2AlCl with hex-1-ene (LiAlH4:(C6H13)2AlCl:hex-1-ene=1.1:1.0:4.5) added; mixt. agitated for 1.5 h at 90°C; cooled; filtered under Ar; solvent and olefin removed (vac., 10 Torr) at60-70°C; elem. anal.;95%

aluminium hydride

592-41-6

1-hexene

1116-73-0

trihexylaluminium

Conditions
ConditionsYield
With triisobutylaluminum In hexane (N2); heating (autoclave, 140°C, 1 h, 120°C, 8 h); distn.; elem. anal.;89.1%
With NaAlEt4 In toluene under N2 or Ar; mixt. of AlH3, NaAlEt4, olefin (3.8 equiv.) and toluene heated at reflux; after 20 min temp. raised from 80 to 100°C and gradually decreased to 70-80°C; 2 h; cooled; filtered; ppt. washed with hexane; solvent and excess olefin removed in vac. at 60-80°C (7 Torr); elem. anal.;
592-47-2

3-hexene

102-67-0

tri-n-propylaluminum

1116-73-0

trihexylaluminium

Conditions
ConditionsYield
Stage #1: 3-hexene; tri-n-propylaluminum at 70℃; under 760.051 Torr; Heating / reflux;
Stage #2: cobalt(III) acetylacetonate In toluene for 2h;
Stage #3: With hydrogenchloride
6.1%
592-41-6

1-hexene

1116-73-0

trihexylaluminium

Conditions
ConditionsYield
With aluminium hydride
With lithium aluminium tetrahydride
1116-73-0

trihexylaluminium

75-36-5

acetyl chloride

111-13-7

hexyl-methyl-ketone

Conditions
ConditionsYield
With aluminium trichloride In dichloromethane for 1h; Product distribution; Ambient temperature; other reaction time; other reagent: ZnCl2; other molecular proportion.;90%
With aluminium trichloride In dichloromethane for 1h; Ambient temperature;90%
1185-96-2

3-acetoxy-3-ethylbutyne

1116-73-0

trihexylaluminium

A

3-methyl-3,4-undecadiene

B

(n-C6H13)2AlOAc

(n-C6H13)2AlOAc

Conditions
ConditionsYield
With iron(III) chloride In various solvent(s) at 40℃; for 15h;A 86%
B n/a
1116-73-0

trihexylaluminium

98-88-4

benzoyl chloride

1671-75-6

Heptanophenone

Conditions
ConditionsYield
With aluminium trichloride In dichloromethane for 1h; Product distribution; Ambient temperature; other molecular proportion.;84%
With aluminium trichloride In dichloromethane for 1h; Ambient temperature;84%
216586-53-7

(1R,2R)-trans-N-phthaloyl-1,2-diaminocyclohexane

1116-73-0

trihexylaluminium

C34H46N2O4

Conditions
ConditionsYield
In toluene at -5 - 50℃; for 7h; Inert atmosphere;81.8%
In toluene at -5 - 50℃; for 7h; Inert atmosphere;81.8%
16212-05-8

(allylsulfonyl)benzene

1116-73-0

trihexylaluminium

124-11-8

non-1-ene

Conditions
ConditionsYield
With dilithium tetrachlorocuprate; triphenylphosphine In octane at 50℃; for 5h;78%
592-41-6

1-hexene

1116-73-0

trihexylaluminium

123-72-8

butyraldehyde

6-butyl-7-methylundecan-4-ol

Conditions
ConditionsYield
Stage #1: 1-hexene; trihexylaluminium With zirconocene dichloride In hexane at 0 - 20℃;
Stage #2: butyraldehyde With copper(l) chloride In hexane at -15 - 20℃;
78%

Tri-n-hexylaluminium Chemical Properties

Molecular structure of Tri-n-hexylaluminium (CAS NO.1116-73-0) is:

Product Name: Tri-n-hexylaluminium
CAS Registry Number: 1116-73-0
IUPAC Name: Trihexylalumane
Molecular Weight: 282.483798 [g/mol]  
Molecular Formula: C18H39Al  
H-Bond Donor: 0  
H-Bond Acceptor: 0
EINECS: 214-241-6
Density: 0.686 g/cm3
Storage temp.: Flammables + water-Freezer (-20 °C)e area
Product Categories: Organometallics
Canonical SMILES: CCCCCC[Al](CCCCCC)CCCCCC
InChI: InChI=1S/3C6H13.Al/c3*1-3-5-6-4-2;/h3*1,3-6H2,2H3; 
InChIKey: ORYGRKHDLWYTKX-UHFFFAOYSA-N

Tri-n-hexylaluminium Safety Profile

Safty information about Tri-n-hexylaluminium (CAS NO.1116-73-0) is:
Hazard Codes: DangerousN; CorrosiveC; FlammableF
Risk Statements: 67-65-62-51/53-48/20-34-14/15-11 
R67:Vapours may cause drowsiness and dizziness. 
R65:Harmful: may cause lung damage if swallowed. 
R62:Risk of impaired fertility. 
R51/53:Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. 
R48/20:Danger of serious damage to health by prolonged exposure and harmful by inhalation. 
R34:Causes burns. 
R14/15 :Reacts violently with water and contact with water liberates extremely flammable gases. 
R11:Highly flammable.
Safety Statements: 6A-61-45-43B-36/37/39-24/25-16 
S6:Keep under ... (there follows the name of an inert gas). 
S61:Avoid release to the environment. Refer to special instructions / safety data sheets. 
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) 
S43:In case of fire use ... (there follows the type of fire-fighting equipment to be used.) 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection. 
S24/25:Avoid contact with skin and eyes. 
S16:Keep away from sources of ignition.
RIDADR: 3051
HazardClass: 4.2
PackingGroup: I

Tri-n-hexylaluminium Specification

 Tri-n-hexylaluminium , its cas register number is 1116-73-0. It also can be called Trihexylalane ;  Aluminum, trihexyl- ; Trihexylaluminium .It is a clear colorless solution.

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