chempirical

Diethylmethoxyborane

C5H13BOCAS 7397-46-899.97 g/mol

Open in Covalent MOL file
BO

Properties

Molecular formula
C5H13BO
Molar mass
99.97 g/mol
Exact mass
100.1059 Da
Boiling point
89–90 °C
logP
1.66Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
3

Identifiers

CAS number
7397-46-8
SMILES
CCB(CC)OC
InChIKey
FESAXEDIWWXCNG-UHFFFAOYSA-N
InChI
InChI=1S/C5H13BO/c1-4-6(5-2)7-3/h4-5H2,1-3H3

Weigh it out

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

Names and synonyms

5 names
  • Borinic acid, B,B-diethyl-, methyl ester
  • Borinic acid, diethyl-, methyl ester
  • Methoxydiethylborane
  • Methyl diethylborinate
  • Diethylboron methoxide

Work with Diethylmethoxyborane

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

Trimethyl borate121-43-735 % similar Triethylborane97-94-935 % similar Trimethoxyboroxine102-24-932 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook