2-Fluoro-6-(trifluoromethyl)aniline
Grundinformationen
- CAS
144851-61-6- Standard-SMILES
Nc1c(F)cccc1C(F)(F)F- InChIKey
CQSFHEFEKDRLKE-UHFFFAOYSA-N- Summenformel
- C7H5F4N
- Durchschnittliche Molmasse
- 179,11 g/mol
- Monoisotopische Masse
- 179,03581204
Namen und Bezeichner
- Bevorzugter Name
- 2-Fluoro-6-(trifluoromethyl)aniline
- IUPAC
- 2-fluoro-6-(trifluoromethyl)aniline
- Englischer Name
- 2-Amino-3-fluorobenzotrifluoride
- Summenformel
- C7H5F4N
- Molmasse
- 179.12
Namen und Synonyme
2-Fluoro-6-(trifluoromethyl)aniline144851-61-6DTXSID50333855RefChem:472518DTXCID60284945626-647-42-Amino-3-fluorobenzotrifluorideBenzenamine, 2-fluoro-6-(trifluoromethyl)-MFCD000612422-fluoro-6-trifluoromethyl-phenylamineSCHEMBL185675a,a,a,6-Tetrafluoro-o-toluidine
Weitere Namen anzeigen
2-amino-3-fluoro-trifluorotoluene2-Amino-3-fluorobenzotrifluoride98%2-Amino-3-fluorobenzotrifluoride 98%(2-Fluoro-6-trifluoroMethylphenyl)aMine2-Fluoro-6-(trifluoroMethyl)aniline 98%2-Fluoro-6-(trifluoromethyl)aniline, 97%ALPHA,ALPHA,ALPHA,6-TETRAFLUORO-O-TOLUIDINE
2-fluoro-6-trifluoromethylaniline2-Fluoro-6-(trifluoromethyl)aniline #PS-85472-fluoro-6-(trifluoromethyl)phenylamineAM61775SCHEMBL21436367SCHEMBL284078742-fluoro-6-trifluoromethyl-aniline
Datenbank-Bezeichner
- CAS
144851-61-6- PubChem CID
- 518959
- DTXSID
DTXSID50333855- EC Number
- 626-647-4
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,2
- Polarare Oberfläche (TPSA)
- 26 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 156
Physikochemische Eigenschaften
- Siedepunkt
- 155 °C · 155 °C(lit.)
- Dichte
- 1.388 g/mL · 1.388 g/mL at 25 °C(lit.)
- Brechungsindex
- 20 · n20/D 1.462(lit.)
- Flammpunkt
- 128 °F · 128 °F
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- Aggregatzustand
- liquid
- pka
- 0.07 · 0.07±0.10(Predicted)
- Farbe
- Clear, colourless
- InChI
- InChI=1S/C7H5F4N/c8-5-3-1-2-4(6(5)12)7(9,10)11/h1-3H,12H2
- InChIKey
- CQSFHEFEKDRLKE-UHFFFAOYSA-N
- SMILES
- C1(N)=C(C(F)(F)F)C=CC=C1F
- CAS Datenbank
- 144851 · 144851-61-6(CAS DataBase Reference)
- NIST chemische Informationen
- 2 · 2-Amino-3-fluorobenzotrifluoride(144851-61-6)
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
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Sicherheitsdaten
- wgk
- 3
- ridadr
- UN 1993 3/PG 3
- hs_code
- 2921420090
- risk_code
- 10-20/21/22-36/37/38
- hazard_code
- Xn,F,Xi
- hazard_note
- Flammable/Harmful/Irritant
- safety_code
- 16-26-27-36/37/39
- hazard_class
- 3
- packing_group
- III
- Speicherklasse
- 3 - Flammable liquids
- Hazard Classifications
- Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralEye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
Chemie und Industrie
Anwendungen
Verwenden2-Fluoro-6-(trifluoromethyl)aniline may be used in the preparation of bis[4-amino-3-fluoro-5-(trifluoromethyl)phenyl]methane.
Anbieter100 Anbieter
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