3-Decanone

C₁₀H₂₀OCAS 928-80-3156.27 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₀H₂₀O
Molar mass: 156.27 g/mol
Exact mass: 156.1514 Da
Melting point: 2.5 °C
Boiling point: 203 °C
logP: 3.33Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 7

Identifiers

CAS number

928-80-3

SMILES

CCCCCCCC(=O)CC

InChIKey

XJLDYKIEURAVBW-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Names and synonyms

1 names

Ethyl heptyl ketone

Work with 3-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

3-Dodecanone1534-27-6100 % similar 3-Hexadecanone18787-64-9100 % similar 3-Undecanone2216-87-7100 % similar 3-Nonanone925-78-0100 % similar 3-Octanone106-68-395 % similar 3-Heptanone106-35-482 % similar 11-Heneicosanone19781-72-777 % similar Hexyl ketone462-18-077 % 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

PubChem CAS Common Chemistry NIST WebBook