Basic information
- CAS
3582-05-6- Standard SMILES
O=S(=O)(OC(F)(F)F)C(F)(F)F- InChIKey
GVZFDPPAJXHNGL-UHFFFAOYSA-N- Molecular formula
- C2F6O3S
- Average molar mass
- 218.08 g/mol
- Monoisotopic mass
- 217.947234
Names & identifiers
- Preferred name
- Trifluoromethyl trifluoromethanesulfonate
- IUPAC
- trifluoromethyl trifluoromethanesulfonate
- English name
- Trifluoromethanesulfonic acid trifluoromethyl ester
- Molecular formula
- C2F6O3S
- Molecular weight
- 218.07
Names & synonyms
trifluoromethyl trifluoromethanesulfonateDTXSID40320072RefChem:899600DTXCID80271195805-991-03582-05-6trifluoromethyl triflateTrifluoromethanesulfonic acid trifluoromethyl estertrifluoromethyl trifluoromethanesulphonateMFCD04973017NSC354415Trifluoromethyltriflate
Show more names
Trifluormethyl triflaterifluoromethyltrifluoromethanesulfonateTrifluoromethanesulfonate trifluoromethyl esterTrifluoromethyl 1,1,1-trifluoromethanesulfonatemethanesulfonicacid,trifluoro-,trifluoromethylester
CF3SO2OCF3C2F6O3SSCHEMBL286824CS-B0884AKOS005259285Trifluormethyl trifluoromethanesulfonateTrifluoromethyltrifluoromethanesulfonateFS-4741
Database identifiers
- CAS
3582-05-6- PubChem CID
- 337239
- DTXSID
DTXSID40320072- EC Number
- 805-991-0
- Nikkaji
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 239
Experimental & physicochemical properties
SpringerMaterials Properties19F nuclear magnetic resonance spectrum
Physicochemical properties
- Melting point
- -108 · -108,2°C
- Boiling point
- 21 °C · 21°C
- Density
- 1.791 · 1.791±0.06 g/cm3(Predicted)
- form
- liquid
- color
- Clear
- InChI
- InChI=1S/C2F6O3S/c3-1(4,5)11-12(9,10)2(6,7)8
- InChIKey
- GVZFDPPAJXHNGL-UHFFFAOYSA-N
- SMILES
- C(F)(F)(F)S(OC(F)(F)F)(=O)=O
- EPA Substance Registry System
- Trifluoromethyl trifluoromethanesulfonate (3582-05-6)
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H314 (93%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 43 reports by companies from 4 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Corr. 1B (93%)
Safety data
- ridadr
- 3308
- hs_code
- 2905190098
- risk_code
- 14-34
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- safety_code
- 23-38
- Hazard statements
- H314
- Precautionary statements
- P260-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338
Chemistry & industry
Applications
UsesTrifluoromethyl Triflate can be used for thermal atomic layer etching processes.
Upstream & downstream products
Downstream products
Suppliers100 total
苏州道澜生物医药科技有限公司15952404857 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
Shanghai Medfine Bio-pharmaceutical Co., Ltd+86-86-13013810076 +86-13013810076 · [email protected]
上海遐瑞医药科技有限公司+86-021-61551413 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
湖北辰心化工有限公司18696113233 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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