2-(3,3-Dimethylbicyclo[2.2.1]hept-2-yliden)ethylacetat

Einecs 218-754-6 · 2-(2,2-Dimethyl-3-norbornylidene)ethyl acetate · 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)ethyl acetate · 2-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)ethanol acetate · Ethanol, 2-(3,3-dimethylbicyclo(2.2.1)hept-2-ylidene)-, acetate · Ethanol, 2-(3,3-dimethylbicyclo(2.2.1)hept-2-ylidene)-, 1-acetate

https://huagongshe.com/de/chemical/5877243

Molekülstruktur von 2-(3,3-Dimethylbicyclo[2.2.1]hept-2-yliden)ethylacetat

Identifikatoren & physikalische Daten

CAS No.	2226-03-1
Summenformel	C13H20O2
Durchschnittliche Molmasse	208,3 g/mol
Monoisotopische Masse	208,14632988 g/mol
SMILES	CC(=O)OC/C=C1\C2CCC(C2)C1(C)C
InChIKey	DVZKEXVVDIXSMK-WUXMJOGZSA-N
PubChem CID	5877243
EC No.	218-754-6
DTXSID	DTXSID801153597
Lokaler Name	2-(3,3-Dimethylbicyclo[2.2.1]hept-2-yliden)ethylacetat

Chemische & physikalische Eigenschaften

XLogP	2,9
Polarare Oberfläche (TPSA)	26,3
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	2
Frei drehbare Bindungen	3
Schwere Atome	15
Formalladung	0
Komplexität	302
Siedepunkt	272.304±9.00 °C(Press: 760.00 Torr)(predicted)
Dichte	1.056±0.06 g/cm3(Temp: 25 °CPress: 760 Torr)(predicted)
LogP (Verteilungskoeffizient)	4.040 (est)
EPA chemische Informationen	Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-, acetate (2226-03-1)

Sicherheit & Vorschriften

GHS-Einstufung	WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 248 reports by companies from 1 notifications to the ECHA C&L Inventory.
Regulatorische Informationen	Chemical: Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-, acetate, (E)-
Hazard Classes and Categories	Acute Tox. 4 (100%)
TSCA-Inventar-Status	TSCA listed