1,2,3-Trifluorobenzene
Grundinformationen
- CAS
1489-53-8- Standard-SMILES
Fc1cccc(F)c1F- InChIKey
AJKNNUJQFALRIK-UHFFFAOYSA-N- Summenformel
- C6H3F3
- Durchschnittliche Molmasse
- 132,08 g/mol
- Monoisotopische Masse
- 132,01868458
Namen und Bezeichner
- Bevorzugter Name
- 1,2,3-Trifluorobenzene
- IUPAC
- 1,2,3-trifluorobenzene
- Englischer Name
- 1,2,3-Trifluorobenzene
- Summenformel
- C6H3F3
- Molmasse
- 132.08
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
1489-53-8- PubChem CID
- 15147
- DTXSID
DTXSID90164125- EC Number
- 625-446-9
- Nikkaji
- J149.700F
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,5
- Polarare Oberfläche (TPSA)
- 0 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 9
- Formalladung
- 0
- Komplexität
- 84
Physikochemische Eigenschaften
- Siedepunkt
- 94 · 94-95 °C (lit.)
- Dichte
- 1.28 g/mL · 1.28 g/mL at 25 °C (lit.)
- Brechungsindex
- 20 · n20/D 1.423(lit.)
- Flammpunkt
- 25 °F · 25 °F
- storage temp.
- Flammables area
- Aggregatzustand
- clear liquid
- Farbe
- Colorless to Light orange to Yellow
- Wichte
- 1.28 · 1.280
- BRN
- 1862388 · 1862388
- Stabilität
- Stable. Highly flammable. Incompatible with strong oxidizing agents.
- InChI
- InChI=1S/C6H3F3/c7-4-2-1-3-5(8)6(4)9/h1-3H
- InChIKey
- AJKNNUJQFALRIK-UHFFFAOYSA-N
- SMILES
- C1(F)=CC=CC(F)=C1F
- CAS Datenbank
- 1489 · 1489-53-8(CAS DataBase Reference)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 5.8% (3 of 52) of reports.
Danger
H225 (92.3%): Highly Flammable liquid and vapor [Danger Flammable liquids];H315 (90.4%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (92.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (90.4%): 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 52 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 3 of 52 reports by companies.;There are 9 notifications provided by 49 of 52 reports by companies with hazard statement code(s).;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
- 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
Verwenden1,2, 3-trifluorobenzene is an organic fluorine compound, mainly used as an intermediate in the production of drugs, agricultural chemicals and dyes.
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