Cyclododecane

C₁₂H₂₄CAS 294-62-2168.32 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₂₄
Molar mass: 168.32 g/mol
Exact mass: 168.1878 Da
Density: 0.82 g/mL (at 80 °C)
Melting point: 60.4 °C
Boiling point: 247 °C
Water solubility: insoluble
logP: 4.68Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Hazards

H413 May cause long lasting harmful effects to aquatic life25% of notifiers

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P273, P501

Identifiers

CAS number

294-62-2

SMILES

C1CCCCCCCCCCC1

InChIKey

DDTBPAQBQHZRDW-UHFFFAOYSA-N

InChI

InChI=1S/C12H24/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-12H2

Weigh it out

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

Work with Cyclododecane

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

Cyclohexane110-82-7100 % similar Cyclopentane287-92-3100 % similar Cycloheptane291-64-5100 % similar Cyclooctane292-64-8100 % similar Cyclodecane293-96-9100 % similar Cyclopentadecane295-48-7100 % similar Cyclopropane75-19-4100 % similar Piperidine110-89-433 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-Dodecene112-41-4 1,3-Diisopropylcyclohexane7045-70-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia