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Name |
Trihexylphosphine |
EINECS | 224-025-3 |
CAS No. | 4168-73-4 | Density | 0,83 g/cm3 |
PSA | 13.59000 | LogP | 7.20920 |
Solubility | N/A | Melting Point |
20℃ |
Formula | C18H39P | Boiling Point | 358.3 °C at 760 mmHg |
Molecular Weight | 286.481 | Flash Point | 179.1 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-36/37/39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Tri-n-hexylphosphine;Trihexylphosphine; |
Article Data | 8 |
n-hexylmagnesium chloride
trihexylphosphine
Conditions | Yield |
---|---|
With trichlorophosphate at -5℃; for 4h; Temperature; | 92.6% |
Conditions | Yield |
---|---|
With phosphorous; Ni(0)bipy In N,N-dimethyl-formamide Electrochemical reaction; Zn anode; | 75% |
Conditions | Yield |
---|---|
With diethyl ether; phosphorus trichloride |
Conditions | Yield |
---|---|
With trichlorosilane; triethylamine |
Conditions | Yield |
---|---|
at 140℃; for 24h; Inert atmosphere; | 99% |
at 140℃; for 24h; Inert atmosphere; | 99% |
at 140℃; for 24h; Inert atmosphere; | 99% |
at 140℃; for 24h; | 99% |
Conditions | Yield |
---|---|
at 140℃; for 24h; Inert atmosphere; | 99% |
at 140℃; for 24h; Inert atmosphere; | 99% |
at 140℃; for 24h; Inert atmosphere; | 99% |
trihexylphosphine
heptyl 2-bromoacetate
tri-n-hexyl(heptoxycarbonylmethyl)phosphonium bromide
Conditions | Yield |
---|---|
at 50℃; for 2h; Inert atmosphere; | 99% |
trihexylphosphine
pentyl 2-bromoacetate
tri-n-hexyl(pentoxycarbonylmethyl)phosphonium bromide
Conditions | Yield |
---|---|
at 50℃; for 2h; Inert atmosphere; | 99% |
trihexylphosphine
chloromethyl methyl ether
tri-n-hexyl(methoxymethyl)phosphonium chloride
Conditions | Yield |
---|---|
at 50℃; for 5h; Inert atmosphere; | 99% |
n-propyl bromoacetate
trihexylphosphine
tri-n-hexyl(propoxycarbonylmethyl)phosphonium bromide
Conditions | Yield |
---|---|
at 50℃; for 2h; Inert atmosphere; | 98% |
The Trihexylphosphine, with the CAS registry number 4168-73-4, is also known as tri-n-Hexylphosphine. It belongs to the product categories of Mitsunobu Reaction; Phosphine Ligands; Phosphines (Mitsunobu Reaction); Synthetic Organic Chemistry. Its EINECS registry number is 224-025-3. This chemical's molecular formula is C18H39P and molecular weight is 286.48. Its systematic name is called trihexylphosphane.
Physical properties of Trihexylphosphine: (1)ACD/LogP: 8.79; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 8.79; (4)ACD/LogD (pH 7.4): 8.79; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 1437727.88; (8)ACD/KOC (pH 7.4): 1437727.88; (9)#Freely Rotating Bonds: 15; (10)Flash Point: 179.1 °C; (11)Enthalpy of Vaporization: 57.99 kJ/mol; (12)Boiling Point: 358.3 °C at 760 mmHg; (13)Vapour Pressure: 5.32E-05 mmHg at 25°C.
Uses of Trihexylphosphine: it can be used to produce dichloro-hexyl-phosphine at temperature of 275 °C. This reaction will need reagent PCl3 with reaction time of 1 hour. The yield is about 64%.
When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)SMILES: P(CCCCCC)(CCCCCC)CCCCCC
(2)InChI: InChI=1/C18H39P/c1-4-7-10-13-16-19(17-14-11-8-5-2)18-15-12-9-6-3/h4-18H2,1-3H3
(3)InChIKey: FPZZZGJWXOHLDJ-UHFFFAOYAW