Basic information
- Standard SMILES
CCCC[N+](CCCC)(CCCC)CCCC.F[B-](F)(F)F- InChIKey
NNZZSJSQYOFZAM-UHFFFAOYSA-N- Molecular formula
- C16H36N.BF4
- Average molar mass
- 329.3 g/mol
- Monoisotopic mass
- 329.28769343
Overview
forms a fluoride-releasing resin when used with bis-GMA
Names & identifiers
- Preferred name
- Tetrabutylammonium Tetrafluoroborate
- IUPAC
- tetrabutylazanium tetrafluoroborate
- English name
- Tetrabutylammonium tetrafluoroborate
- Molecular formula
- C16H36BF4N
- Molecular weight
- 329.27
Names & synonyms
Show more names
Database identifiers
- CAS
429-42-5- PubChem CID
- 67932
- DTXSID
DTXSID7059983- ChEMBL
CHEMBL1078071- EC Number
- 207-058-8
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 12
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 135
Experimental & physicochemical properties
Physicochemical properties
- Melting point
- 155 · 155-161 °C(lit.)
- Flash point
- 93 ℃ · >93℃
- storage temp.
- 20 °C · −20°C
- solubility
- 0.1 g/mL, · methanol: 0.1 g/mL, clear, colorless
- form
- Crystalline Powder
- color
- White
- Water Solubility
- Slightly soluble
- Sensitive
- Hygroscopic
- BRN
- 3577508 · 3577508
- InChI
- InChI=1S/C16H36N.BF4/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;2-1(3,4)5/h5-16H2,1-4H3;/q+1;-1
- InChIKey
- DWWRDPSMLREDKW-UHFFFAOYSA-M
- SMILES
- [N+](CCCC)(CCCC)(CCCC)CCCC.[B-](F)(F)(F)F
- CAS DataBase Reference
- 429 · 429-42-5(CAS DataBase Reference)
- NIST Chemistry Reference
- Tetrabutylammonium tetrafluoroborate(429-42-5)
- EPA Substance Registry System
- 1 · 1-Butanaminium, N,N,N-tributyl-, tetrafluoroborate(1-) (429-42-5)
- UNSPSC Code
- 26111700 · 26111700
- NACRES
- 61 · NB.61
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H315-H318-H335
- Precautionary statements
- 261 · P261-P280-P305+P351+P338
- target organs
- Respiratory system
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xi,T,Xn
- Risk Statements
- 36 · 36/37/38-41-37/38-22
- Safety Statements
- 26 · 26-36-37/39-39
- RIDADR
- 1759 · UN 1759 8/PG III
- WGK Germany
- 3 · 3
- Hazard Note
- Irritant/Hygroscopic
- TSCA
- TSCA listed
- HazardClass
- TOXIC, HYGROSCOPIC
- PackingGroup
- III
- HS Code
- 29239000 · 29239000
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 4 OralEye · Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2STOT SE 3
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 1% (1 of 99) of reports.
Danger
H302 (47.5%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 99 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: 1-Butanaminium, N,N,N-tributyl-, tetrafluoroborate(1-)
Tetrabutylammonium tetrafluoroborate: Does not have an individual approval but may be used under an appropriate group standard
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 1759 8/PG III
- hs_code
- 29239000
- risk_code
- 36/37/38-41-37/38-22
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- hazard_code
- Xi,T,Xn
- hazard_note
- Irritant/Hygroscopic
- safety_code
- 26-36-37/39-39
- hazard_class
- TOXIC, HYGROSCOPIC
- Storage Class
- 11 - Combustible Solids
- packing_group
- III
- target organs
- Respiratory system
- Hazard statements
- H302-H315-H318-H335
- Hazard Classifications
- Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P280-P305+P351+P338
Chemistry & industry
Uses & manufacturing
Applications
UsesTetrabutylammonium tetrafluoroborate may be used in the following studies: As supporting electrolyte in the voltammetric determination of Δ(9)-tetrahydrocannabinol (Δ(9)-THC). Synthesis of biologically relevant macrolactones, Sansalvamide A. As supporting electrolyte in the determination of the oxidation and reduction potentials of 5,10,15,20-tetra[3-(3-trifluoromethyl)phenoxy]porphyrin by cyclic voltammetry. Preparation of 1:1 adduct with 1,10-phenanthroline.Used to prepare other tetrabutylammonium salts in aqueous solutions. As electrolyte additive in the synthesis of conducting poly(thiophenes).
UsesTBATFB has been used as an electrolyte to understand the paraffin graphite powder modified with sweet potato tissue (PCPET) electrode response.
General DescriptionTetrabutylammonium tetrafluoroborate (TBATFB) is a phase transfer catalyst. It can be synthesized by the reaction between 30% aqueous solution of tetrafluoroboric acid and 40% aqueous solution of tetrabutylamonium hydroxide. Tetrabutylammonium tetrafluoroborate acts as an electrolyte and inhibits the self-assembly of alkylthiosulfate on gold.
Suppliers50 total
Related reactions
Linked notes
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