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| CAS No.: | 429-07-2 |
|---|---|
| Name: | Tetraethylammonium hexafluorophosphate |
| Article Data: | 8 |
| Molecular Structure: | |
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| Formula: | C8H20F6NP |
| Molecular Weight: | 275.218 |
| Synonyms: | N,N,N-triethylethanaminium hexafluorophosphate;Ethanaminium, N,N,N-triethyl-, hexafluorophosphate (1-);Ethanaminium, N,N,N-triethyl-, hexafluorophosphate(1-) (9CI);Ammonium, tetraethyl-, hexafluorophosphate (1-);N,N,N-triethylethanaminium hexafluorophosphate;Ethanaminium, N,N,N-triethyl-, hexafluorophosphate(1-) (9CI); |
| EINECS: | 207-056-7 |
| Melting Point: | ≥300 °C(lit.) |
| Solubility: | acetonitrile: 0.1 g/mL, clear, colorless |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 13.59000 |
| LogP: | 5.26520 |
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Specification
The Tetraethylammonium hexafluorophosphate, with the CAS registry number 429-07-2 and EINECS registry number 207-056-7, has the systematic name of N,N,N-triethylethanaminium hexafluorophosphate. And the molecular formula of this chemical is C8H20F6NP. It belongs to the following product categories: Ammonium SaltsAnalytical Reagents; Electrochemistry; Supporting Electrolytes for Electrochemistry; Ammonium Salts; Greener Alternatives: Catalysis; Phase Transfer Catalysts. What's more, it is used as supporting electrolyte, and it is also used in the produce of antiseptic.
The physical properties of Tetraethylammonium hexafluorophosphate are as following: (1)ACD/LogP: -3.17; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.17; (4)ACD/LogD (pH 7.4): -3.17; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 0 Å2.
You should be cautious while dealing with this chemical. It irritates eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: F[P-](F)(F)(F)(F)F.CC[N+](CC)(CC)CC
(2)InChI: InChI=1/C8H20N.F6P/c1-5-9(6-2,7-3)8-4;1-7(2,3,4,5)6/h5-8H2,1-4H3;/q+1;-1
(3)InChIKey: KLKUOIXSIDDDCN-UHFFFAOYAF
The toxicity data is as follows:
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intravenous | 56mg/kg (56mg/kg) | U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04258, |