Grundinformationen
- Standard-SMILES
FC(F)(F)c1cnc(Cl)c(Cl)c1- InChIKey
ABNQGNFVSFKJGI-UHFFFAOYSA-N- Summenformel
- C6H2Cl2F3N
- Durchschnittliche Molmasse
- 215,98 g/mol
- Monoisotopische Masse
- 214,95163908
Namen und Bezeichner
- Bevorzugter Name
- 2,3-Dichloro-5-(trifluoromethyl)pyridine
- IUPAC
- 2,3-dichloro-5-(trifluoromethyl)pyridine
- Englischer Name
- 2,3-Dichloro-5-(trifluoromethyl)pyridine
- Summenformel
- C6H2Cl2F3N
- Molmasse
- 215.99
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
69045-84-7- PubChem CID
- 112234
- DTXSID
DTXSID7074080- UNII
- 5F2C8LX8IE
- EC Number
- 410-340-5、614-913-2
- Nikkaji
- J43.077C
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,3
- Polarare Oberfläche (TPSA)
- 12,9 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 161
Experimentelle und physikochemische Eigenschaften
PFAS
PFAS -> PFAS identified in REACH Regulation EC No. 1272/2008
PFAS -> Suspected persistent, mobile, toxic (PMT) PFAS or PFAS-like compounds
Physikochemische Eigenschaften
- Schmelzpunkt
- 8 · 8-9 °C
- Siedepunkt
- 80 °C20 · 80 °C20 mm Hg(lit.)
- Dichte
- 1.549 g/mL · 1.549 g/mL at 25 °C(lit.)
- Brechungsindex
- 20 · n20/D 1.475(lit.)
- Flammpunkt
- 175 °F · 175 °F
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Löslichkeit
- soluble in Chloroform, Methanol
- pka
- -3.34 · -3.34±0.10(Predicted)
- Aggregatzustand
- Liquid
- Wichte
- 1.549 · 1.549
- Farbe
- Clear colorless to yellow
- InChI
- InChI=1S/C6H2Cl2F3N/c7-4-1-3(6(9,10)11)2-12-5(4)8/h1-2H
- InChIKey
- ABNQGNFVSFKJGI-UHFFFAOYSA-N
- SMILES
- C1(Cl)=NC=C(C(F)(F)F)C=C1Cl
- CAS Datenbank
- 69045 · 69045-84-7(CAS DataBase Reference)
- EPA chemische Informationen
- 2 · 2,3-Dichloro-5-(trifluoromethyl)pyridine (69045-84-7)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H302: Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P321, P330, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Danger
H302+H332 (31.9%): Harmful if swallowed or if inhaled [Warning Acute toxicity, oral; acute toxicity, inhalation]
P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P321, P330, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Gefahrenhinweise
Regulatory Information
Pyridine, 2,3-dichloro-5-(trifluoromethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Pyridine, 2,3-dichloro-5-(trifluoromethyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 15-06-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/11164
Hazard Classes and Categories
Acute Tox. 4 (98.7%)
Acute Tox. 4 (100%)
Eye damage - category 1
Acute Tox. 4 *
Sicherheitsdaten
- wgk
- 2
- tsca
- TSCA listed
- ridadr
- UN 3082 9/PG 3
- hs_code
- 29333990
- risk_code
- 20/22-41-43-51/53-36/37/38
- hazard_code
- Xn,N,Xi
- hazard_note
- Irritant
- safety_code
- 24-26-37/39-61-36
- hazard_class
- 9
- packing_group
- III
- Speicherklasse
- 10 - Combustible liquids
- Hazard Classifications
- Acute Tox. 4 InhalationAcute Tox. 4 OralAquatic Chronic 2Eye Dam. 1Skin Sens. 1
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing Information
Pesticide, Fertilizer, and Other Agricultural Chemical Manufacturing
Pyridine, 2,3-dichloro-5-(trifluoromethyl)-: ACTIVE
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