chempirical

9-Methoxy-9-borabicyclo[3.3.1]nonane

C9H17BOCAS 38050-71-4152.04 g/mol

Open in Covalent MOL file
OB

Properties

Molecular formula
C9H17BO
Molar mass
152.04 g/mol
Exact mass
152.1372 Da
Boiling point
57–58 °C (at 7 Torr)
logP
2.73Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Identifiers

CAS number
38050-71-4
SMILES
COB1C2CCCC1CCC2
InChIKey
UNGDGQYONLTNJZ-UHFFFAOYSA-N
InChI
InChI=1S/C9H17BO/c1-11-10-8-4-2-5-9(10)7-3-6-8/h8-9H,2-7H2,1H3

Weigh it out

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

Names and synonyms

5 names
  • 9-Borabicyclo[3.3.1]nonane, 9-methoxy-
  • B-Methoxy-9-borabicyclo[3.3.1]nonane
  • 9-Methoxy-BBN
  • B-Methoxy-9-BBN
  • 9-MeO-9-BBN

Work with 9-Methoxy-9-borabicyclo[3.3.1]nonane

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Cyclopentyl methyl ether5614-37-935 % similar Trimethyl borate121-43-730 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook