Grundinformationen
- Standard-SMILES
CC(N)C(F)(F)F- InChIKey
SNMLKBMPULDPTA-UHFFFAOYSA-N- Summenformel
- C3H6F3N
- Durchschnittliche Molmasse
- 113,08 g/mol
- Monoisotopische Masse
- 113,04523385
Namen und Bezeichner
- Bevorzugter Name
- 1,1,1-Trifluoro-2-propanamine
- IUPAC
- 1,1,1-trifluoropropan-2-amine
- Englischer Name
- 1-(Trifluoromethyl)ethylamine
- Summenformel
- C3H6F3N
- Molmasse
- 113.08
Namen und Synonyme
1,1,1-trifluoropropan-2-amine421-49-81,1,1-trifluoro-2-propanamineDTXSID901307602RefChem:409447DTXCID60862964806-637-82-Amino-1,1,1-trifluoropropaneMFCD049730201-(Trifluoromethyl)ethylamine1,1,1-trifluoro-2-propylamineSCHEMBL234663
Weitere Namen anzeigen
uoropropan-2-amine1,1,1-Trifluoroprop-2-ylaMine1,1,1-Trifluoro-2-aMinopropane2-PropanaMine,1,1,1-trifluoro-1,1,1-TRIFLUORO-ISOPROPYLAMINE
2,2,2-trifluoro-1-methylethylamine1,1,1-TRIFLUOROISOPROPYLAMINEAKOS005762894SY035354L-2,2,2,-trifluoro-1-(methyl)ethylamineCS-0022346N12201C3H6F3N
Datenbank-Bezeichner
- CAS
421-49-8- PubChem CID
- 3783165
- DTXSID
DTXSID901307602- UNII
- 49QD2666SS
- EC Number
- 806-637-8
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0,8
- Polarare Oberfläche (TPSA)
- 26 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 7
- Formalladung
- 0
- Komplexität
- 57,7
Physikochemische Eigenschaften
- Schmelzpunkt
- 0 °C · 0°C
- Siedepunkt
- 0 °C · 0°C
- Dichte
- 1.148 · 1.148±0.06 g/cm3(Predicted)
- Brechungsindex
- 1.321 · 1.3210
- Flammpunkt
- 0 °C · 0°C
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- Aggregatzustand
- liquid
- pka
- 5.82 · 5.82±0.50(Predicted)
- Farbe
- Colourless
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P319, P321, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Sicherheitsdaten
- ridadr
- 2734
- hs_code
- 2921199990
- risk_code
- 20/21/22-36/37/38
- hazard_code
- Xn
- safety_code
- 26-36
- hazard_class
- IRRITANT
Chemie und Industrie
Anwendungen
Verwenden1-(Trifluoromethyl)ethylamine is a flurorinated propanamine derivative used as a building block in the synthesis of pharmaceutical compounds such as hNav1.7 channel blockers and anti-cancer agents.
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