methoxyethane

• ChemBase ID: 128323
• Molecular Formular: C3H8O
• Molecular Mass: 60.09502
• Monoisotopic Mass: 60.05751488
• SMILES: COCC
• Canonical SMILES: COCC
• InChI: InChI=1S/C3H8O/c1-3-4-2/h3H2,1-2H3
• InChIKey: XOBKSJJDNFUZPF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: methoxyethane
• IUPAC Traditional name: methoxyethane
• Synonyms: Methyl ethyl ether; Ethyl methyl ether; Methoxyethane

Database IDs

• CAS Number: 540-67-0
• PubChem SID: 162222631
• PubChem CID: 10903
• Wikipedia Title: Methoxyethane

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 0.4813574
• LogD (pH = 7.4): 0.4813574
• Log P: 0.4813574
• Molar Refractivity: 17.7611 cm^3
• Polarizability: 6.946336 Å^3
• Polar Surface Area: 9.23 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Colorless gas
• Melting Point: -113°C
• Boiling Point: 7.4°C
• Density: 0.7251 g cm^-3 (at 0 °C)
• Refractive Index: 1.3420 (at 4?°C)
• Viscosity: 0.224 cP at 25 °C

Safety Information

• Main Hazard: Extremely Flammable (F+),; Liquefied gas