Grundinformationen
- Standard-SMILES
Fc1cc(F)c(F)cc1F- InChIKey
SDXUIOOHCIQXRP-UHFFFAOYSA-N- Summenformel
- C6H2F4
- Durchschnittliche Molmasse
- 150,07 g/mol
- Monoisotopische Masse
- 150,00926271
Namen und Bezeichner
- Bevorzugter Name
- 1,2,4,5-Tetrafluorobenzene
- IUPAC
- 1,2,4,5-tetrafluorobenzene
- Lokaler Name
- 1,2,4,5-Tetrafluorbenzol
- Englischer Name
- 1,2,4,5-Tetrafluorobenzene
- Summenformel
- C6H2F4
- Molmasse
- 150.07
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
327-54-8- PubChem CID
- 9474
- DTXSID
DTXSID90186367- UNII
- AB3CL8US2H
- EC Number
- 206-319-3
- Nikkaji
- J28K
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,3
- Polarare Oberfläche (TPSA)
- 0 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 10
- Formalladung
- 0
- Komplexität
- 90
Experimentelle und physikochemische Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- 4 °C · 4 °C (lit.)
- Siedepunkt
- 90 °C · 90 °C (lit.)
- Dichte
- 1.344 g/mL · 1.344 g/mL at 25 °C (lit.)
- Brechungsindex
- 20 · n20/D 1.407(lit.)
- Flammpunkt
- 61 °F · 61 °F
- storage temp.
- 2 · Sealed in dry,2-8°C
- Aggregatzustand
- clear liquid
- Farbe
- Colorless to Almost colorless
- Wichte
- 1.344 · 1.344
- Wasserlöslichkeit
- Not miscible or difficult to mix in water.
- BRN
- 1909052 · 1909052
- Henry's Law Constant
- 5.6 · 5.6×10-4 mol/(m3Pa) at 25℃, Duchowicz et al. (2020)
- InChI
- InChI=1S/C6H2F4/c7-3-1-4(8)6(10)2-5(3)9/h1-2H
- InChIKey
- SDXUIOOHCIQXRP-UHFFFAOYSA-N
- SMILES
- C1(F)=CC(F)=C(F)C=C1F
- CAS Datenbank
- 327 · 327-54-8(CAS DataBase Reference)
- NIST chemische Informationen
- 1 · Benzene, 1,2,4,5-tetrafluoro-(327-54-8)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (98.5%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, 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 68 reports by companies from 7 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
- wgk
- 3
- ridadr
- UN 1993 3/PG 2
- hs_code
- 29039990
- risk_code
- 11-36/37/38
- hazard_code
- F,Xi
- hazard_note
- Flammable/Irritant
- safety_code
- 16-26-36/37/39-37/39-33-7/9
- hazard_class
- 3
- packing_group
- II
- Speicherklasse
- 3 - Flammable liquids
- Hazard Classifications
- Eye Irrit. 2Flam. Liq. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
Anwendungen
VerwendenIt is employed as intermediate in organic synthesis. It is also used as pharmaceutical intermediate.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Nachgelagerte Produkte
Anbieter50 Anbieter
Zugehörige Reaktionen
Verknüpfte Notizen
Wird geladen…