Ethyl 5,5-diphenyl-2-isoxazoline-3-carboxylate
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Grundinformationen
- CAS
163520-33-0- Standard-SMILES
CCOC(=O)C1=NOC(c2ccccc2)(c2ccccc2)C1- InChIKey
MWKVXOJATACCCH-UHFFFAOYSA-N- Summenformel
- C18H17NO3
- Durchschnittliche Molmasse
- 295,338 g/mol
- Monoisotopische Masse
- 295,1208434
Namen und Bezeichner
- Bevorzugter Name
- Ethyl 5,5-diphenyl-2-isoxazoline-3-carboxylate
- IUPAC
- Ethyl 5,5-diphenyl-4,5-dihydro-1,2-oxazole-3-carboxylate
- Englischer Name
- Isoxadifen-ethyl
- Summenformel
- C18H17NO3
- Molmasse
- 295.33
Namen und Synonyme
4,5-Dihydro-5,5-diphenyl-3-isoxazolecarboxylic acid ethyl esteraef122006Isoxadifen etilIsoxadifen-ethylDibenzoxazolic acidDiphenyloxazolic acidIsoxadifen ethyl esterC14480500 Isoxadifen-ethylIsoxadifen-ethyl (Standard)isoxadifen-ethyl(bsi,pa iso)
Datenbank-Bezeichner
- CAS
163520-33-0- PubChem CID
- 6451155
- DTXSID
DTXSID7040360- ChEMBL
CHEMBL3185294- ChEBI
CHEBI:132497- UNII
- 71LF32W32E
- EC Number
- 443-870-0、605-330-4
- Nikkaji
- J2.688.212E
Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- 87 · 87-88℃ (ethyl ether )
- Siedepunkt
- 407.7 · 407.7±55.0 °C(Predicted)
- Dichte
- 1.15 · 1.15±0.1 g/cm3 (20 ºC 760 Torr)
- Dampfdruck
- 0 Pa · 0Pa at 20℃
- storage temp.
- Sealed in dry,Room Temperature
- Aggregatzustand
- Solid
- Farbe
- White to Almost white
- Wasserlöslichkeit
- 1.06 mg/L · 1.06mg/L at 20℃
- Major Application
- agricultureenvironmental
- InChI
- InChI=1S/C18H17NO3/c1-2-21-17(20)16-13-18(22-19-16,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3
- InChIKey
- MWKVXOJATACCCH-UHFFFAOYSA-N
- SMILES
- O1C(C2=CC=CC=C2)(C2=CC=CC=C2)CC(C(OCC)=O)=N1
- LogP
- 3.8 at · 3.8 at 30℃
- EPA chemische Informationen
- Isoxadifen-ethyl (163520-33-0)
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN3077 9/PG 3
- hs_code
- 2934.99.1800
- RTECS-Nr.
- NY2390000
- risk_code
- 22-43-50-50/53
- hazard_code
- Xn,N
- safety_code
- 36/37-61-60-22
- hazard_class
- 9
- packing_group
- III
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Acute Tox. 4 OralAquatic Acute 1Aquatic Chronic 1Skin Sens. 1
Chemie und Industrie
Anwendungen
VerwendenIsoxadifen-ethyl is a particularly useful pesticide.
Vor- und nachgelagerte Produkte
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Ergänzende Hinweise
DefinitionChEBI: Isoxadifen-ethyl is an isoxazoline that is the ethyl ester of isoxadifen. It is used as a herbicide safener, especially in conjunction with the herbicides fenoxaprop-P-ethyl and iodosulfuron-methyl-sodium. It is not approved for use within the European Union. It has a role as a herbicide safener and an agrochemical. It is an ethyl ester and an isoxazoline. It is functionally related to an isoxadifen.
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