chempirical

Diethoxymethane

C5H12O2CAS 462-95-3104.15 g/mol

Open in Covalent MOL file
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AcetalEther

Properties

Molecular formula
C5H12O2
Molar mass
104.15 g/mol
Exact mass
104.0837 Da
Density
0.7879 g/mL (at 20 °C)
Melting point
−66.5 °C
Boiling point
88 °C
logP
1.02Crippen estimate
Polar surface area
18.5 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
4

Identifiers

CAS number
462-95-3
SMILES
CCOCOCC
InChIKey
KLKFAASOGCDTDT-UHFFFAOYSA-N
InChI
InChI=1S/C5H12O2/c1-3-6-5-7-4-2/h3-5H2,1-2H3

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

11 names
  • Ethane, 1,1′-[methylenebis(oxy)]bis-
  • Methane, diethoxy-
  • 1,1′-[Methylenebis(oxy)]bis[ethane]
  • Ethylal
  • Diethylformal
  • Formaldehyde diethyl acetal
  • Ethoxymethyl ethyl ether
  • 1,1-Diethoxymethane
  • 3,5-Dioxaheptane
  • NSC 6754
  • (Ethoxymethoxy)ethane

Work with Diethoxymethane

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Diethyl ether60-29-767 % similar Ethylene glycol diethyl ether629-14-157 % similar Diethylene glycol diethyl ether112-36-753 % similar (Chloromethoxy)ethane3188-13-447 % similar Ethyl propyl ether628-32-047 % similar Ethoxyethylamine110-76-942 % similar 2-Ethoxyethanol110-80-542 % similar 1-Chloro-2-ethoxyethane628-34-242 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Isopropoxyethanol109-59-1 1,5-Pentanediol111-29-5 4-Methoxy-1-butanol111-32-0 3-Ethoxy-1-propanol111-35-3 Neopentyl glycol126-30-7 1-Ethoxy-2-propanol1569-02-4 (2R)-2-Methyl-1,4-butanediol22644-28-6 3-Methoxybutanol2517-43-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook