Ethyl acetohydroximate

HCID 99894CAS 10576-12-2

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

Standard-SMILES: CCOC(C)=NO
InChIKey: QWKAVVNRCKPKNM-UHFFFAOYSA-N
Summenformel: C4H9NO2
Durchschnittliche Molmasse: 103,12 g/mol
Monoisotopische Masse: 103,06332853

Überblick

structure in first source

Namen und Bezeichner

Bevorzugter Name: Ethyl acetohydroximate
IUPAC: ethyl N-hydroxyethanimidate

Namen und Synonyme

Ethyl acetohydroximateRefChem:138198Ethyl N-hydroxyethanimidateEthanimidic acid, N-hydroxy-, ethyl ester10576-12-2Ethyl N-hydroxyacetimidate20703-42-8PHX9UH9AV1N-Hydroxyethanimidic acid, ethyl ester(E)-Ethyl N-hydroxyacetimidate(Z)-Ethyl N-hydroxyacetimidateN-Hydroxyacetimidic Acid Ethyl Ester

Weitere Namen anzeigen

NSC-255004EINECS 234-165-7NSC 255004UNII-PHX9UH9AV1ethyl-N-hydroxyacetimidateETHYL ACETATE, OXIMEethyl N-hydroxyethaneimidoateSCHEMBL513886

Datenbank-Bezeichner

CAS: 10576-12-2
PubChem CID: 99894
DTXSID: DTXSID2065129
UNII: PHX9UH9AV1
EC Number: 234-165-7

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,7
Polarare Oberfläche (TPSA): 41,8 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 2
Schwere Atome: 7
Formalladung: 0
Komplexität: 70,1

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H226 (89.1%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 46 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.