Ethofumesate-2-keto

EthofumesateImpurity1 · Ethofumesate-2-keto 10.0 μg/ml Cyclohexane · Ethofumesate-2-keto 10 μg/mL in Cyclohexane · Ethofumesate Impurity 1 (Ethofumesate-2-keto) · 3,3-Dimethyl-5-[(methylsulfonyl)oxy]-2(3H)-benzofuranone · 2(3H)-Benzofuranone, 3,3-dimethyl-5-[(methylsulfonyl)oxy]- · 2,3-dihydro-3-3-dimethyl-2-oxo-5-benzofuranylmethanesulfonate · (S)-Cyano(3-phenoxyphenyl)methyl (1S,3S)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropane-1-carboxylate

https://huagongshe.com/de/chemical/590774

Identifikatoren & physikalische Daten

CAS No.	26244-33-7
Summenformel	C11H12O5S
Durchschnittliche Molmasse	256,28 g/mol
Monoisotopische Masse	256,04054465 g/mol
SMILES	CC1(C)C(=O)Oc2ccc(OS(C)(=O)=O)cc21
InChIKey	CXWYCAYNZXSHTF-UHFFFAOYSA-N
PubChem CID	590774
ChEBI	CHEBI:83510
DTXSID	DTXSID90343594

Chemische & physikalische Eigenschaften

XLogP	1,8
Polarare Oberfläche (TPSA)	78,1
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	5
Frei drehbare Bindungen	2
Schwere Atome	17
Formalladung	0
Komplexität	420
Siedepunkt	396.9±42.0 °C(Predicted)
Dichte	1.352±0.06 g/cm3(Predicted)
Hauptanwendungen	agricultureenvironmental
InChI	1S/C11H12O5S/c1-11(2)8-6-7(16-17(3,13)14)4-5-9(8)15-10(11)12/h4-6H,1-3H3
InChIKey	CXWYCAYNZXSHTF-UHFFFAOYSA-N
SMILES	CC1(C)C(=O)Oc2ccc(OS(C)(=O)=O)cc12

Sicherheit & Vorschriften

Wassergefährdungsklasse (WGK)	3
UN-Transportnummer	UN3077 9/PG 3
R-Sätze (R)	51/53
Gefahrensymbole	N
Sicherheitshinweise (S)	61
Lagerklasse	11 - Combustible Solids
Gefahrenklasse	Acute Tox. 4 DermalAcute Tox. 4 OralAquatic Acute 1Aquatic Chronic 1

Anwendungen & Verwendung

Verwenden

Ethofumesate-2-keto is a sulfinated benzofuran compound. It is the major product of the degradation products that were found after applying Ethofumesate (E895103(P)) to dry soil. A herbicide. It is also an intermediate in the synthesis of HMSPP (H115020), a metabolite of Ethofumesate.