3-Amino-5-methylbenzotrifluoride
Grundinformationen
- CAS
96100-12-8- Standard-SMILES
Cc1cc(N)cc(C(F)(F)F)c1- InChIKey
WYDJMBLMXGCHOL-UHFFFAOYSA-N- Summenformel
- C8H8F3N
- Durchschnittliche Molmasse
- 175,15 g/mol
- Monoisotopische Masse
- 175,06088392
Namen und Bezeichner
- Bevorzugter Name
- 3-Amino-5-methylbenzotrifluoride
- IUPAC
- 3-methyl-5-(trifluoromethyl)aniline
- Englischer Name
- 3-Methyl-5-trifluoromethylaniline
- Summenformel
- C8H8F3N
- Molmasse
- 175.15
Namen und Synonyme
3-Amino-5-methylbenzotrifluorideRefChem:497424816-381-996100-12-83-methyl-5-(trifluoromethyl)aniline3-Methyl-5-trifluoromethylanilineMFCD016315805-Methyl-3-(trifluoromethyl)aniline3-methyl -5-(trifluoromethyl)anilineSCHEMBL658517DTXSID903722233-Methyl-5-Amino Benzotrif
Weitere Namen anzeigen
3-Methyl-5-(trifluoroMethyl)benzenaMine3-methyl-5-thifluoromethylaniline3-Amino-5-methylbenzotrifluoride 97%3-methyl-5-trifluoromethylaniline(MTA)3-Amino-5-methylbenzotrifluoride, 97+%BENZENAMINE, 3-METHYL-5-TRIFLUOROMETHYL3-Methyl-5-(trifluoromethyl)aniline, 3-Amino-5-(trifluoromethyl)toluene
SCHEMBL276505243-Methyl-5-Amino Benzotrifluoride5-methyl-3-trifluoromethylani-lineCL8435SBB070203AKOS006229811CS-W005539PS-8608
Datenbank-Bezeichner
- CAS
96100-12-8- PubChem CID
- 2737713
- DTXSID
DTXSID90372223- EC Number
- 816-381-9
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,1
- Polarare Oberfläche (TPSA)
- 26 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 155
Physikochemische Eigenschaften
- Siedepunkt
- 203.3 · 203.3±40.0 °C(Predicted)
- Dichte
- 1.237 · 1.237±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- pka
- 3.5 · 3.50±0.10(Predicted)
- Aggregatzustand
- solid
- Farbe
- Off White
- CAS Datenbank
- 96100 · 96100-12-8(CAS DataBase Reference)
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
Danger
H301+H311 (33.3%): Toxic if swallowed or in contact with skin [Danger Acute toxicity, oral; acute toxicity, dermal]
P260, P261, P262, P264, P264+P265, P270, P271, P280, P284, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P320, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 3 (33.3%)
Sicherheitsdaten
- ridadr
- 2811
- hs_code
- 2921490090
- risk_code
- 23/24/25
- hazard_code
- T
- hazard_note
- Toxic
- safety_code
- 23-26-28-36/37/39-45
Chemie und Industrie
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