1,1,1-trifluoro-N-methyl-methanesulfonamide
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Grundinformationen
- CAS
34310-29-7- Standard-SMILES
CNS(=O)(=O)C(F)(F)F- InChIKey
IJOCNCZJDBTBIP-UHFFFAOYSA-N- Summenformel
- C2H4F3NO2S
- Durchschnittliche Molmasse
- 163,12 g/mol
- Monoisotopische Masse
- 162,99148403
Namen und Bezeichner
- Bevorzugter Name
- 1,1,1-trifluoro-N-methyl-methanesulfonamide
- IUPAC
- 1,1,1-trifluoro-N-methylmethanesulfonamide
- Englischer Name
- N-MethyltrifluoroMethanesulfonaMide
- Summenformel
- C2H4F3NO2S
- Molmasse
- 163.12
Namen und Synonyme
1,1,1-trifluoro-N-methyl-methanesulfonamideRefChem:409490839-801-234310-29-7N-METHYLTRIFLUOROMETHANESULFONAMIDEN-methyl trifluoromethanesulfonamide1,1,1-trifluoro-N-methylmethanesulfonamideMethanesulfonamide, 1,1,1-trifluoro-N-methyl-N-methyl-trifluoromethanesulfonamideMFCD11649749SCHEMBL1760887SCHEMBL2000972
Weitere Namen anzeigen
SCHEMBL2565881N-MethyltrifluoroMethanesulfoMideSCHEMBL10586562DTXSID60500177IJOCNCZJDBTBIP-UHFFFAOYSA-NOUDQAKIRGZZMAU-UHFFFAOYSA-NXKAHPMOKUWIKEX-UHFFFAOYSA-NCS-B0880
Datenbank-Bezeichner
- CAS
34310-29-7- PubChem CID
- 12489741
- DTXSID
DTXSID60500177- EC Number
- 839-801-2
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 0,5
- Polarare Oberfläche (TPSA)
- 54,6 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 9
- Formalladung
- 0
- Komplexität
- 175
Physikochemische Eigenschaften
- Siedepunkt
- 80 ℃ · 80℃ (10 Torr)
- Dichte
- 1.513 · 1.513±0.06 g/cm3(Predicted)
- Löslichkeit
- sol THF, chloroform, methylene chloride.
- pka
- 7.56 · 7.56±0.40(Predicted)
- InChI
- InChI=1S/C2H4F3NO2S/c1-6-9(7,8)2(3,4)5/h6H,1H3
- InChIKey
- IJOCNCZJDBTBIP-UHFFFAOYSA-N
- SMILES
- C(F)(F)(F)S(NC)(=O)=O
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)
Sicherheitsdaten
- hs_code
- 2935909099
Chemie und Industrie
Anwendungen
BeschreibungN-MethyltrifluoroMethanesulfonaMide is a dioxane that is used as an intermediate for the production of other chemicals. It has been shown to form bifurcated intramolecular hydrogen bonds and isomers with stereospecificity. The molecule can be prepared by reacting methylamine with chlorotrifluoromethane followed by hydrolysis of the resulting N-MethyltrifluoroMethanesulfonaMide chloride. This compound is soluble in both water and organic solvents, such as methanol, ethanol, acetone, and chloroform. It has been found to have a high affinity for amines and amides and will form hydrogen bonds with these compounds.
VerwendenN,N-Diethyl-1,1,1-trifluoromethanesulfonamide is used in the preparation of hexaalkylguanidinium trifluoromethanesulfonates from tetraalkylureas, triflic anhydride and secondary amines and their properties as ionic liquids.
Anbieter64 Anbieter
Hebei Zhuanglai Chemical Trading Co Ltd+86-16264648883 · [email protected]
湖北科麦迪化工有限公司18372743325 · [email protected]
上海遐瑞医药科技有限公司+86-021-61551413 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
武汉绿景丰华生物科技有限公司19972070065 · [email protected]
北京安司莫森技术有限公司010-82954736 13391601435 · [email protected]
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