{2-[2-(ethenyloxy)ethoxy]ethoxy}ethene

• ChemBase ID: 146118
• Molecular Formular: C8H14O3
• Molecular Mass: 158.19496
• Monoisotopic Mass: 158.09429431
• SMILES: C=COCCOCCOC=C
• Canonical SMILES: C=COCCOCCOC=C
• InChI: InChI=1S/C8H14O3/c1-3-9-5-7-11-8-6-10-4-2/h3-4H,1-2,5-8H2
• InChIKey: SAMJGBVVQUEMGC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: {2-[2-(ethenyloxy)ethoxy]ethoxy}ethene
• IUPAC Traditional name: {2-[2-(ethenyloxy)ethoxy]ethoxy}ethene
• Synonyms: 1,5-Divinyloxy-3-oxapentane; Diethylene glycol divinyl ether; Di(ethylene glycol) divinyl ether; 二乙二醇二甲醚乙烯醚; 二乙二醇二乙烯基醚

Database IDs

• CAS Number: 764-99-8
• EC Number: 212-133-3
• MDL Number: MFCD00054610
• Beilstein Number: 1752316
• PubChem SID: 24848420; 162240317
• PubChem CID: 12998

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 1.0399473
• LogD (pH = 7.4): 1.0399473
• Log P: 1.0399473
• Molar Refractivity: 42.4839 cm^3
• Polarizability: 17.063988 Å^3
• Polar Surface Area: 27.69 Å^2
• Rotatable Bonds: 8
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: -21°C
• Boiling Point: 198-199 °C(lit.); 198-199°C
• Flash Point: 159.8 °F; 71 °C; 83°C(181°F)
• Density: 0.968; 0.968 g/mL at 25 °C(lit.)
• Refractive Index: 1.4470; n20/D 1.446(lit.)

Safety Information

• Storage Warning: Light Sensitive
• RTECS: KN3850000
• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 2
• Risk Statements: 36/38
• Safety Statements: 26-37
• TSCA Listed: 是
• GHS Pictograms: GHS07
• GHS Hazard statements: H315-H319-H227-H303
• GHS Precautionary statements: P210-P305+P351+P338-P302+P352-P321-P403+P235-P501A
• Personal Protective Equipment: Eyeshields, Gloves, half-mask respirator (US), multi-purpose combination respirator cartridge (US)

Product Information

• Purity: 98%, stab. 0.1% potassium hydroxide; 99%
• Linear Formula: (H2C=CHOCH2CH2)2O

DETAILS

Sigma Aldrich - 139548

Packaging
50 mL in poly bottle