2-Decanone

C₁₀H₂₀OCAS 693-54-9156.27 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₀H₂₀O
Molar mass: 156.27 g/mol
Exact mass: 156.1514 Da
Density: 0.823 g/mL (at 22 °C)
Melting point: 14 °C
Boiling point: 210 °C
logP: 3.33Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 7

Identifiers

CAS number

693-54-9

SMILES

CCCCCCCCC(C)=O

InChIKey

ZAJNGDIORYACQU-UHFFFAOYSA-N

InChI

InChI=1S/C10H20O/c1-3-4-5-6-7-8-9-10(2)11/h3-9H2,1-2H3

Weigh it out

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

Names and synonyms

3 names

Methyl octyl ketone
Methyl n-octyl ketone
Octyl methyl ketone

Work with 2-Decanone

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

2-Octanone111-13-7100 % similar 2-Undecanone112-12-9100 % similar 2-Tetradecanone2345-27-9100 % similar 2-Pentadecanone2345-28-0100 % similar 2-Tridecanone593-08-8100 % similar 2-Dodecanone6175-49-1100 % similar 2-Nonadecanone629-66-3100 % similar 2-Nonanone821-55-6100 % similar

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

Same formula

2-Ethylhexyl vinyl ether103-44-6 Citronellol106-22-9 (+)-Citronellol1117-61-9 Decanal112-31-2 9-Decen-1-ol13019-22-2 2-tert-Butylcyclohexanol13491-79-7 Menthol1490-04-6 (+)-Menthol15356-60-2

Elsewhere

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