Grundinformationen
- Standard-SMILES
OC(c1ccccc1)c1ccc(C(F)(F)F)cc1- InChIKey
LIZDGCXCDJOWBS-UHFFFAOYSA-N- Summenformel
- C14H11F3O
- Durchschnittliche Molmasse
- 252,23 g/mol
- Monoisotopische Masse
- 252,07619946
Namen und Bezeichner
- Bevorzugter Name
- 4-(Trifluoromethyl)benzhydrol
- IUPAC
- phenyl-[4-(trifluoromethyl)phenyl]methanol
- Englischer Name
- 4-(Trifluoromethyl)benzhydrol
- Summenformel
- C14H11F3O
- Molmasse
- 252.23
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
395-23-3- PubChem CID
- 258897
- DTXSID
DTXSID50293288- ChEMBL
CHEMBL611616- EC Number
- 636-800-7
- Nikkaji
- J1.461.854F
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,6
- Polarare Oberfläche (TPSA)
- 20,2 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 18
- Formalladung
- 0
- Komplexität
- 250
Physikochemische Eigenschaften
- Schmelzpunkt
- 59 °C · 59 °C
- Siedepunkt
- 122 °C · 122 °C
- Dichte
- 1.257 · 1.257±0.06 g/cm3(Predicted)
- Flammpunkt
- 122 · 122-124°C/0.4mm
- storage temp.
- 2 · 2-8°C
- pka
- 13.1 · 13.10±0.20(Predicted)
- BRN
- 2127184 · 2127184
- CAS Datenbank
- 395 · 395-23-3(CAS DataBase Reference)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (86.7%): 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)
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.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Sicherheitsdaten
- ridadr
- 1224
- hs_code
- 2906290090
- risk_code
- 36/37/38
- hazard_code
- F
- safety_code
- 26-36/37/39
- hazard_class
- FLAMMABLE
Chemie und Industrie
Anbieter29 Anbieter
Zugehörige Reaktionen
Verknüpfte Notizen
Wird geladen…