1,1-Diethoxyethene

HCID 137673CAS 2678-54-8

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Grundinformationen

Standard-SMILES: C=C(OCC)OCC
InChIKey: VTGIVYVOVVQLRL-UHFFFAOYSA-N
Summenformel: C6H12O2
Durchschnittliche Molmasse: 116,16 g/mol
Monoisotopische Masse: 116,08372962

Namen und Bezeichner

Bevorzugter Name: 1,1-Diethoxyethene
IUPAC: 1,1-diethoxyethene
Englischer Name: 1,1-diethoxyethylene
Summenformel: C6H12O2
Molmasse: 116.16

Namen und Synonyme

1,1-DiethoxyetheneRefChem:5926002678-54-8Ketene diethyl acetalEthene, 1,1-diethoxy-1,1-diethoxyethyleneMFCD00467747Ketene diethylacetalKetene, diethyl acetaldiethoxyethylene1,1diethoxyethylene1,1-diethoxy-ethene

Weitere Namen anzeigen

1353381,1-DiethoxyethenDiethyl ketene acetal1,1-Diethoxyethene, stabilized2-(1-ethoxypropoxy)ethen-1-oneKETENE DIETHYL ACETAL STAB. WACKER &

1-ethoxy-ethenoxy-ethaneSCHEMBL388497SCHEMBL12115269DTXSID50181292VTGIVYVOVVQLRL-UHFFFAOYSA-NAKOS015949588AS-57084FD181813

Datenbank-Bezeichner

CAS: 2678-54-8
PubChem CID: 137673
DTXSID: DTXSID50181292
EC Number: 620-977-2
Nikkaji: J485.131E

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,7
Polarare Oberfläche (TPSA): 18,5 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 4
Schwere Atome: 8
Formalladung: 0
Komplexität: 60

Physikochemische Eigenschaften

Siedepunkt: 49 · 49-50 °C(lit.)
Dichte: 0.88 g/mL · 0.880 g/mL at 20 °C(lit.)
Brechungsindex: 20 · n20/D 1.414
Flammpunkt: 27 °C · 27 °C
storage temp.: 2 · 2-8°C
Löslichkeit: soluble in THF, ether, benzene; decomposes in water, ethanol.
InChI: InChI=1S/C6H12O2/c1-4-7-6(3)8-5-2/h3-5H2,1-2H3
InChIKey: VTGIVYVOVVQLRL-UHFFFAOYSA-N
SMILES: C(OCC)(OCC)=C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

Sicherheitsdaten

wgk: 3
ridadr: UN 1993 3/PG 3
risk_code: 10
safety_code: 23

Chemie und Industrie

Anwendungen

Verwenden1,1-diethoxyethylene can be used as organic synthesis intermediate and pharmaceutical intermediate, mainly used in laboratory research and development process and chemical production process.