Cyclododecanone

C₁₂H₂₂OCAS 830-13-7182.31 g/mol

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Properties

Molecular formula: C₁₂H₂₂O
Molar mass: 182.31 g/mol
Exact mass: 182.1671 Da
Density: 0.9059 g/mL (at 66 °C)
Melting point: 59 °C
Boiling point: 126–128 °C
logP: 3.86Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Identifiers

CAS number

830-13-7

SMILES

O=C1CCCCCCCCCCC1

InChIKey

SXVPOSFURRDKBO-UHFFFAOYSA-N

InChI

InChI=1S/C12H22O/c13-12-10-8-6-4-2-1-3-5-7-9-11-12/h1-11H2

Weigh it out

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

Names and synonyms

1 names

NSC 77116

Work with Cyclododecanone

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

Same formula

2-Heptylcyclopentanone137-03-1 (E)-2-Dodecenal20407-84-5 13-Oxabicyclo[10.1.0]tridecane286-99-7 Codlemone33956-49-9 Geranyl ethyl ether40267-72-9

Elsewhere

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