4-[2-(Trifluoromethyl)phenoxy]piperidine
Grundinformationen
- CAS
824390-04-7- Standard-SMILES
FC(F)(F)c1ccccc1OC1CCNCC1- InChIKey
MBZJEIRMMYDAFD-UHFFFAOYSA-N- Summenformel
- C12H14F3NO
- Durchschnittliche Molmasse
- 245,24 g/mol
- Monoisotopische Masse
- 245,10274873
Namen und Bezeichner
- Bevorzugter Name
- 4-[2-(Trifluoromethyl)phenoxy]piperidine
- IUPAC
- 4-[2-(trifluoromethyl)phenoxy]piperidine
- Englischer Name
- 4-[2-(Trifluoromethyl)phenoxy]piperidine
- Summenformel
- C12H14F3NO
- Molmasse
- 245.24
Namen und Synonyme
824390-04-74-[2-(trifluoromethyl)phenoxy]piperidine4-(2-(trifluoromethyl)phenoxy)piperidineMFCD062488814-[2-(trifluoromethyl)phenoxy)piperidine4-[2-{Trifluoromethyl}phenoxy]piperidinePiperidine, 4-[2-(trifluoromethyl)phenoxy]-4-[(2-Trifluoromethylphenyl)oxy]piperidine4-(2-Trifluoromethyl-Phenoxy)-Piperidine4-(2-TRIFLUOROMETHYLPHENOXY)PIPERIDINESCHEMBL83377SCHEMBL2093618
Weitere Namen anzeigen
4-(2-Trifluoromethyl-phQSy)piperidine4-2-(Trifluoromethyl)phenoxyüpiperidine
SCHEMBL3118290DTXSID60407571STL069263AKOS000181167SB432094-[2-(trifluoromethyl) phenoxy]piperidine4-[2-(trifluoromethyl)phenoxy]-piperidine4-[2-(trifluoromethyl)-phenoxy]-piperidine
Datenbank-Bezeichner
- CAS
824390-04-7- PubChem CID
- 5018790
- DTXSID
DTXSID60407571- EC Number
- 676-835-5
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,9
- Polarare Oberfläche (TPSA)
- 21,3 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 17
- Formalladung
- 0
- Komplexität
- 238
Physikochemische Eigenschaften
- Siedepunkt
- 96 · 96-97°C/0.5mm
- Dichte
- 1.193 · 1.193
- Flammpunkt
- 136 °C · 136 °C
- storage temp.
- 2 · 2-8°C
- pka
- 9.66 · 9.66±0.10(Predicted)
- Wasserlöslichkeit
- Slightly soluble in water.
- CAS Datenbank
- 824390 · 824390-04-7
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Sicherheitsdaten
- hs_code
- 2933399990
- hazard_code
- Xi
- hazard_class
- IRRITANT
Chemie und Industrie
Anwendungen
VerwendenIt is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuff.
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