Grundinformationen
- Standard-SMILES
Oc1c(F)ccc(Cl)c1F- InChIKey
CCLYWHXHYLQWQK-UHFFFAOYSA-N- Summenformel
- C6H3ClF2O
- Durchschnittliche Molmasse
- 164,54 g/mol
- Monoisotopische Masse
- 163,98404884
Namen und Bezeichner
- Bevorzugter Name
- 3-Chloro-2,6-difluorophenol
- IUPAC
- 3-chloro-2,6-difluorophenol
- Englischer Name
- 3-CHLORO-2,6-DIFLUOROPHENOL
- Summenformel
- C6H3ClF2O
- Molmasse
- 164.54
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
261762-51-0- PubChem CID
- 2773564
- DTXSID
DTXSID20378556- EC Number
- 670-790-5
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,4
- Polarare Oberfläche (TPSA)
- 20,2 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 10
- Formalladung
- 0
- Komplexität
- 122
Physikochemische Eigenschaften
- storage temp.
- 2 · 2-8°C
- Aggregatzustand
- solid
- InChI
- 1S/C6H3ClF2O/c7-3-1-2-4(8)6(10)5(3)9/h1-2,10H
- InChIKey
- CCLYWHXHYLQWQK-UHFFFAOYSA-N
- SMILES
- Oc1c(F)ccc(Cl)c1F
- CAS Datenbank
- 261762 · 261762-51-0
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H302 (80%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Sicherheitsdaten
- wgk
- WGK 3
- ridadr
- 2811
- hs_code
- 2908190090
- risk_code
- 20/21/22-36/37/38
- hazard_code
- T
- hazard_note
- Toxic
- safety_code
- 26-36/37/39
- hazard_class
- 8
- packing_group
- III
- Speicherklasse
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard Classifications
- Acute Tox. 3 Oral
Chemie und Industrie
Anwendungen
Verwenden3-Chloro-2,6-difluorophenol is often used as a chemical synthesis intermediate and can be used to synthesize certain types of herbicides, fungicides or pesticides. In addition, it can also be used in materials science to synthesize specific polymers or plastic additives.
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