chempirical

1,11-Dibromoundecane

C11H22Br2CAS 16696-65-4314.10 g/mol

Open in Covalent MOL file
BrBr
Alkyl halide

Properties

Molecular formula
C11H22Br2
Molar mass
314.10 g/mol
Exact mass
312.0088 Da
Melting point
166 °C
Boiling point
170–175 °C (at 15 Torr)
logP
5.29Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
10

Identifiers

CAS number
16696-65-4
SMILES
BrCCCCCCCCCCCBr
InChIKey
SIBVHGAPHVRHMJ-UHFFFAOYSA-N
InChI
InChI=1S/C11H22Br2/c12-10-8-6-4-2-1-3-5-7-9-11-13/h1-11H2

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

Names and synonyms

1 names
  • Undecane, 1,11-dibromo-

Work with 1,11-Dibromoundecane

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

1,5-Dibromopentane111-24-0100 % similar 1,12-Dibromododecane3344-70-5100 % similar 1,7-Dibromoheptane4549-31-9100 % similar 1,8-Dibromooctane4549-32-0100 % similar 1,9-Dibromononane4549-33-1100 % similar 1,6-Dibromohexane629-03-8100 % similar 1,4-Dibromobutane110-52-189 % similar 1,3-Dibromopropane109-64-870 % similar

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

Elsewhere

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