chempirical

Dibutyl ether

C8H18OCAS 142-96-1130.23 g/mol

Open in Covalent MOL file
O
Ether

Properties

Molecular formula
C8H18O
Molar mass
130.23 g/mol
Exact mass
130.1358 Da
Density
0.7684 g/mL (at 20 °C)
Melting point
−95.2 °C
Boiling point
140.2 °C
logP
2.60Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
6

Identifiers

CAS number
142-96-1
SMILES
CCCCOCCCC
InChIKey
DURPTKYDGMDSBL-UHFFFAOYSA-N
InChI
InChI=1S/C8H18O/c1-3-5-7-9-8-6-4-2/h3-8H2,1-2H3

Weigh it out

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

Names and synonyms

10 names
  • Butane, 1,1′-oxybis-
  • Butyl ether
  • 1,1′-Oxybis[butane]
  • Di-n-butyl ether
  • Dibutyl oxide
  • n-Butyl ether
  • Butyl oxide
  • NSC 8459
  • n-Bu2O
  • 1-Butoxybutane

Work with Dibutyl ether

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

Glycol dibutyl ether112-48-193 % similar Diethylene glycol dibutyl ether112-73-293 % similar 5,8,11,14,17-Pentaoxaheneicosane112-98-193 % similar Pentyl ether693-65-280 % similar Dihexyl ether112-58-375 % similar Octyl ether629-82-375 % similar Butyl ethyl ether628-81-971 % similar 3-Butoxy-1-propanol10215-33-568 % similar

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

Same formula

2-Ethylhexanol104-76-7 1-Octanol111-87-5 2-Octanol123-96-6 5-Methyl-3-heptanol18720-65-5 2,5-Dimethyl-3-hexanol19550-07-3 3-Octanol20296-29-1 2,3,4-Trimethyl-3-pentanol3054-92-0 2,5-Dimethyl-2-hexanol3730-60-7

Elsewhere

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