Basic information
- CAS
99337-56-1- Standard SMILES
CCCC[N+](CCCC)(CCCC)CCCC.F.F.[F-]- InChIKey
MRXQMNWIADOAJY-UHFFFAOYSA-M- Molecular formula
- C16H38F3N
- Average molar mass
- 301.47 g/mol
- Monoisotopic mass
- 301.29563488
Overview
See other relationships...
Names & identifiers
- Preferred name
- N,N,N-Tributylbutan-1-aminium fluoride--hydrogen fluoride (1/1/2)
- IUPAC
- tetrabutylazanium;fluoride;dihydrofluoride
- English name
- Tetra-n-butylammonium dihydrogentrifluoride
- Molecular formula
- C16H36N.F3H2
- Molecular weight
- 301.48
Names & synonyms
DTXSID20471859N,N,N-Tributylbutan-1-aminium fluoride--hydrogen fluoride (1/1/2)RefChem:1090332DTXCID3042267599337-56-1tetrabutylammonium fluoride dihydrofluoridetetra-n-butylammonium dihydrogentrifluorideTetra-n-butylammonium dihydrogen trifluoride148305-65-1Dihydrogen tetrabutylammonium fluoridetetrabutylazanium;fluoride;dihydrofluorideMFCD00145365
Show more names
SKL003Rp-8-Br-cAMPS sodiumTetra-n-butylammonium dihydrogentrifluoride,tech. 90%tetrabutylammoniumdihydrogentrifluoride,50-55wt.%solutionin1,2-dichloroethaneTetra-n-butylammonium dihydrogentrifluoride, 50-55% w/w soln. in 1,2-dichloroethane
hydron;tetrabutylazanium;trifluorideTetrabutylammonium Dihydrogen TrifluorideN,N,N-Tributyl-1-butanaminium fluoride hydrofluoride (1:1:2)C16H38F3NTetrabutylammonium (dihydrogen trifluoride)SCHEMBL226111tetrabutylamonium dihydrogentrifluorideAKOS025212300
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 12
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 116
Physicochemical properties
- Density
- 0 · 0,966 g/cm3
- Flash point
- 13 °C · 13 °C
- storage temp.
- 0 · 0-6°C
- solubility
- soluble in dichloromethane
- form
- Solution
- color
- Clear light yellow to brown
- Exposure limits
- 10 ppmOSHA: · ACGIH: TWA 10 ppmOSHA: Ceiling 100 ppm; TWA 50 ppmNIOSH: IDLH 50 ppm; TWA 1 ppm(4 mg/m3); STEL 2 ppm(8 mg/m3)
- CAS DataBase Reference
- 99337 · 99337-56-1(CAS DataBase Reference)
- Symbol(GHS)
- 5 · GHS05,GHS07,GHS02,GHS08
- Signal word
- Danger
- Hazard statements
- 225 · H225-H302-H312-H314-H318-H332-H335-H350
- Precautionary statements
- 260 h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a-P210 · P260h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a-P210
- Hazard Codes
- T-F,C,F
- Risk Statements
- 45 · 45-35-23/24/25-11-34-20/21/22
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- ridadr
- 2922
- hs_code
- 29239000
- risk_code
- 45-35-23/24/25-11-34-20/21/22
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07,GHS02,GHS08
- hazard_code
- T-F,C,F
- safety_code
- 53-45-36/37/39-26-16-62-51-22/23-4
- hazard_class
- 8
- packing_group
- III
- Hazard statements
- H225-H302-H312-H314-H318-H332-H335-H350
- Limited Quantities
- 1.0 L (0.3 gallons) (liquid) or 1 Kg (2.2 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
- Precautionary statements
- P260h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a-P210
Chemistry & industry
Applications
UsesTetrabutylammonium Dihydrogen Trifluoride is a powerful catalyst and is used in the regioselective opening of epoxides with activated aromatic and heteroaromatic chlorides
Suppliers49 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
武汉凯威斯科技有限公司
Related reactions
28 records
Compound notes
Loading…