1-Bromo-3-fluoro-2-nitrobenzene
Grundinformationen
- CAS
886762-70-5- Standard-SMILES
O=[N+]([O-])c1c(F)cccc1Br- InChIKey
VFPAOFBPEYCAAZ-UHFFFAOYSA-N- Summenformel
- C6H3BrFNO2
- Durchschnittliche Molmasse
- 220 g/mol
- Monoisotopische Masse
- 218,93312
Namen und Bezeichner
- Bevorzugter Name
- 1-Bromo-3-fluoro-2-nitrobenzene
- IUPAC
- 1-bromo-3-fluoro-2-nitrobenzene
- Englischer Name
- 2-Bromo-6-fluoronitrobenzene
- Summenformel
- C6H3BrFNO2
- Molmasse
- 220
Namen und Synonyme
1-bromo-3-fluoro-2-nitrobenzene886762-70-5DTXSID10382465RefChem:75108DTXCID90333490689-316-32-Bromo-6-fluoronitrobenzene2-fluoro-6-bromonitrobenzeneMFCD073687881-bromo-3-fluoro-2-nitro-benzeneSCHEMBL418362MB04477
Weitere Namen anzeigen
3-bromo-3-fluoro-2-nitrobenzene2-Bromo-6-fluoronitrobenzene 97%1-Bromo-3-fluoro-2-nitrobenzene >1-Bromo-3-fluoro-2-nitrobenzene ISO 9001：2015 REACH
SY022869B4842Benzene, 1-bromo-3-fluoro-2-nitro-BCP11728FT-0647528SCHEMBL29532105CL8951SBB068702
Datenbank-Bezeichner
- CAS
886762-70-5- PubChem CID
- 2783152
- DTXSID
DTXSID10382465- EC Number
- 689-316-3
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,5
- Polarare Oberfläche (TPSA)
- 45,8 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 161
Physikochemische Eigenschaften
- Schmelzpunkt
- 36 · 36-37°C
- Siedepunkt
- 232 · 232.0±20.0 °C(Predicted)
- Dichte
- 1.808 · 1.808±0.06 g/cm3(Predicted)
- Flammpunkt
- 87 ° · 87°
- storage temp.
- 2 · 2-8°C
- Löslichkeit
- soluble in Methanol
- Aggregatzustand
- powder to lump
- Farbe
- White to Orange to Green
- InChI
- InChI=1S/C6H3BrFNO2/c7-4-2-1-3-5(8)6(4)9(10)11/h1-3H
- InChIKey
- VFPAOFBPEYCAAZ-UHFFFAOYSA-N
- SMILES
- C1(Br)=CC=CC(F)=C1[N+]([O-])=O
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (50%): 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 (50%): 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 4 reports by companies from 4 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
Hazard Classes and CategoriesAcute Tox. 4 (50%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (50%)
Sicherheitsdaten
- hs_code
- 29042090
- risk_code
- 36/38
- hazard_code
- Xi
- safety_code
- 36
- hazard_class
- IRRITANT
Chemie und Industrie
Anwendungen
Verwenden2-Bromo-6-fluoronitrobenzene is a hydrocarbon derivative, mainly used as an organic intermediate.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
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