O-(2-(Vinyloxy)ethyl)hydroxylamine

HCID 21867017CAS 391212-29-6

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Grundinformationen

Standard-SMILES: C=COCCON
InChIKey: XZTSFVPMMQNIAJ-UHFFFAOYSA-N
Summenformel: C4H9NO2
Durchschnittliche Molmasse: 103,12 g/mol
Monoisotopische Masse: 103,06332853

Namen und Bezeichner

Bevorzugter Name: O-(2-(Vinyloxy)ethyl)hydroxylamine
IUPAC: O-(2-ethenoxyethyl)hydroxylamine
Englischer Name: O-(2-(vinyloxy)ethyl)hydroxylamine
Summenformel: C4H9NO2
Molmasse: 103.12

Namen und Synonyme

O-(2-(Vinyloxy)ethyl)hydroxylamineO-[2-(Vinyloxy)ethyl]hydroxylamineRefChem:855101811-731-7391212-29-6O-(2-ethenoxyethyl)hydroxylamineO-[2-(ethenyloxy)ethyl]hydroxylamineMFCD09951926O-(2-vinyloxyethyl)hydroxylamine1-[2-(aminooxy)ethoxy]ethyleneHydroxylamine, O-[2-(ethenyloxy)ethyl]-RefChem

Weitere Namen anzeigen

O-(2-(Vinyloxy)2-(Vinyloxy)ethoxyaMineSelumetinib IntermediateO-(2-(Vinyloxy)ethyl)hydroxylamine95%methyl 2-((2-fluoro-4-iodophenyl)amino)-1,5-dimethyl-6-oxo-1,6-dihydropyridine-3-carboxylate

SCHEMBL219339DTXSID40619094XZTSFVPMMQNIAJ-UHFFFAOYSA-NO-(2-vinyloxy-ethyl)hydroxylamineO-(2-vinyloxyethyl)-hydroxylamineCS-M0262O-(2-vinyloxy-ethyl)-hydroxylamineO-(2-(vinyl-oxy)ethyl)hydroxylamine

Datenbank-Bezeichner

CAS: 391212-29-6
PubChem CID: 21867017
DTXSID: DTXSID40619094
EC Number: 811-731-7

Eigenschaften

Berechnete Struktureigenschaften

XLogP: -0,1
Polarare Oberfläche (TPSA): 44,5 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 4
Schwere Atome: 7
Formalladung: 0
Komplexität: 47

Physikochemische Eigenschaften

Siedepunkt: 60 · 60-65 °C(Press: 20 Torr)
Dichte: 0.972 · 0.972
storage temp.: -20 °C, · -20°C, protect from light, stored under nitrogen
pka: 4.07 · 4.07±0.70(Predicted)
InChI: InChI=1S/C4H9NO2/c1-2-6-3-4-7-5/h2H,1,3-5H2
InChIKey: XZTSFVPMMQNIAJ-UHFFFAOYSA-N
SMILES: NOCCOC=C
CAS Datenbank: 391212 · 391212-29-6

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

This chemical does not meet GHS hazard criteria for 33.3% (1 of 3) of reports.

Danger

H227 (33.3%): Combustible liquid [Warning Flammable liquids]

P210, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesFlam. Liq. 4 (33.3%)

Sicherheitsdaten

hs_code: 2928009090

Chemie und Industrie

Anwendungen

VerwendenO-(2-(vinyloxy)ethyl)hydroxylamine is a pharmaceutical intermediate compound used in the preparation of the antitumour agents Selumetinib and Binimetinib.