Pyrifenox
Grundinformationen
- CAS
88283-41-4- Standard-SMILES
CON=C(Cc1cccnc1)c1ccc(Cl)cc1Cl- InChIKey
CKPCAYZTYMHQEX-UHFFFAOYSA-N- Summenformel
- C14H12Cl2N2O
- Durchschnittliche Molmasse
- 295,2 g/mol
- Monoisotopische Masse
- 294,03266836
Überblick
a fungicide; structure in first source
Namen und Bezeichner
- Bevorzugter Name
- Pyrifenox
- IUPAC
- 1-(2,4-dichlorophenyl)-N-methoxy-2-pyridin-3-ylethanimine
- Englischer Name
- PYRIFENOX
- Summenformel
- C14H12Cl2N2O
- Molmasse
- 295.16
Namen und Synonyme
Pyrifenox88283-41-4DTXSID20423599QNU6BZ7LOCHEBI:81972RefChem:930368DTXCID00223592',4'-Dichloro-2-(3-pyridyl)acetophenone O-methyloximeRo 15-12971-(2,4-dichlorophenyl)-N-methoxy-2-pyridin-3-ylethanimine(E)-PYRIFENOXPyrifenox 1
Weitere Namen anzeigen
RONDODORADOCoradoKoradoNRK 297FD 4060POLIGROLPodigrolACR 3651ro15-1297
Pyrifenox 2SCHEMBL22695orb1705476CHEMBL1863315SCHEMBL29586383IDA22722MSK21076Pyrifenox 10 |Ig/mL in Isooctane
Datenbank-Bezeichner
- CAS
88283-41-4- PubChem CID
- 55790
- DTXSID
DTXSID2042359- ChEMBL
CHEMBL1863315- EC Number
- 618-138-0
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,5
- Polarare Oberfläche (TPSA)
- 34,5 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 19
- Formalladung
- 0
- Komplexität
- 312
Experimentelle und physikochemische Eigenschaften
Pesticides
Fungicides
Active substance -> EU Pesticides database: Not approved
Fungicides
LogP2.51
Collision Cross Section167.08 Ų [M+H]+
Physikochemische Eigenschaften
- Schmelzpunkt
- 25 ℃ · <25℃
- Siedepunkt
- 0.1 · bp0.1 >150°
- Dichte
- 1.389 · 1.3890 (rough estimate)
- Brechungsindex
- 1.549 · 1.5490 (estimate)
- Flammpunkt
- 145 °C · 145 °C
- storage temp.
- 0 · 0-6°C
- Löslichkeit
- Chloroform (Slightly), Methanol (Slightly)
- pka
- 4.76 · 4.76±0.10(Predicted)
- Farbe
- Yellow
- Merck
- 13 · 13,8073
- Henry's Law Constant
- 2.3 · 2.3×102 mol/(m3Pa) at 25℃, Ebert et al. (2023)
- Major Application
- agricultureenvironmental
- InChI
- 1S/C14H12Cl2N2O/c1-19-18-14(7-10-3-2-6-17-9-10)12-5-4-11(15)8-13(12)16/h2-6,8-9H,7H2,1H3/b18-14-
- InChIKey
- CKPCAYZTYMHQEX-JXAWBTAJSA-N
- SMILES
- CO\N=C(\Cc1cccnc1)c2ccc(Cl)cc2Cl
- CAS Datenbank
- 88283 · 88283-41-4
- EPA chemische Informationen
- Pyrifenox (88283-41-4)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (57.6%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 66 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information2002/2076
Other Safety InformationIMAP assessments - Ethanone, 1-(2,4-dichlorophenyl)-2-(3-pyridinyl)-, O-methyloxime: Environment tier I assessment
Hazard Classes and CategoriesAcute Tox. 4 (57.6%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 29333990
- RTECS-Nr.
- KM5772000
- risk_code
- 22
- Toxizität
- LD50 in rats (mg/kg): 950 i.p.; 2900 orally; >5000 dermally; LC50 by inhalation in rats: >2.05 mg/l (Zobrist)
- hazard_code
- Xn
- Speicherklasse
- 10 - Combustible liquids
- Hazard Classifications
- Acute Tox. 4 Oral
Chemie und Industrie
Verwendung und Herstellung
Use ClassificationFungicides
Anwendungen
VerwendenAgricultural fungicide.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Anbieter30 Anbieter
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Ergänzende Hinweise
DefinitionChEBI: An oxime O-ether that is the O-methyloxime of 2',4'-dichloro-2-(3-pyridyl)acetophenone. A fungicide used for control of powdery mildew, scab and other fungal pathogens on a range of crops.
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