Ethyl 2-methylidenebutanoate

HCID 291416CAS 3070-65-3

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Grundinformationen

Standard-SMILES: C=C(CC)C(=O)OCC
InChIKey: OUGJKAQEYOUGKG-UHFFFAOYSA-N
Summenformel: C7H12O2
Durchschnittliche Molmasse: 128,17 g/mol
Monoisotopische Masse: 128,08372962

Namen und Bezeichner

Bevorzugter Name: Ethyl 2-methylidenebutanoate
IUPAC: ethyl 2-methylidenebutanoate
Englischer Name: ETHYL 2-ETHYLACRYLATE 96
Summenformel: C7H12O2
Molmasse: 128.17

Namen und Synonyme

ethyl 2-methylidenebutanoateRefChem:594480631-154-2Ethyl 2-ethylacrylate3070-65-3ethyl 2-methylenebutanoateButanoic acid, 2-methylene-, ethyl esterMFCD05664266Ethyl 2-methylenebutyrateButanoic acid,2-methylene-, ethyl esterethyl ethylacrylateETHYL 2-ETHYLACRYLATE 96

Weitere Namen anzeigen

Ethyl ethacrylateETHYL 2-ETHYLACRYLATE 96

Ethyl2-ethylacrylateNSC156618Ethyl 2-ethylpropenoateEthyl 2-ethyl-2-propenoateEthyl 2-ethylacrylate 96%SCHEMBL35720Ethyl 2-ethylacrylate, 96%SCHEMBL8580014

Datenbank-Bezeichner

CAS: 3070-65-3
PubChem CID: 291416
DTXSID: DTXSID10303099
EC Number: 631-154-2
Nikkaji: J815.814B

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,9
Polarare Oberfläche (TPSA): 26,3 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 4
Schwere Atome: 9
Formalladung: 0
Komplexität: 116

Physikochemische Eigenschaften

Siedepunkt: 139 · 139-145 °C (lit.)
Dichte: 0.902 g/mL · 0.902 g/mL at 25 °C (lit.)
Brechungsindex: 20 · n20/D 1.421(lit.)
Flammpunkt: 89 °F · 89 °F
storage temp.: 2 · 2-8°C
InChI: InChI=1S/C7H12O2/c1-4-6(3)7(8)9-5-2/h3-5H2,1-2H3
InChIKey: OUGJKAQEYOUGKG-UHFFFAOYSA-N
SMILES: C(OCC)(=O)C(=C)CC

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

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

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P273, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 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. 3 (100%)

Sicherheitsdaten

wgk: 2
ridadr: UN 1993 3/PG 3
risk_code: 36/37/38-51/53-11
hazard_code: Xi,N,F
safety_code: 26-28-61
Speicherklasse: 3 - Flammable liquids
Hazard Classifications: Aquatic Chronic 2Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3