2-Hexylcyclopentanone

C₁₁H₂₀OCAS 13074-65-2168.28 g/mol

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Properties

Molecular formula: C₁₁H₂₀O
Molar mass: 168.28 g/mol
Exact mass: 168.1514 Da
Boiling point: 118 °C (at 10 Torr)
logP: 3.33Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 5

Identifiers

CAS number

13074-65-2

SMILES

CCCCCCC1CCCC1=O

InChIKey

JTHVYOIHZNYRCC-UHFFFAOYSA-N

InChI

InChI=1S/C11H20O/c1-2-3-4-5-7-10-8-6-9-11(10)12/h10H,2-9H2,1H3

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

Names and synonyms

4 names

Cyclopentanone, 2-hexyl-
2-n-Hexylcyclopentanone
2-Hexyl-1-cyclopentanone
Jasmatone

Work with 2-Hexylcyclopentanone

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

Same formula

Ethyl linalool10339-55-6 10-Undecenal112-45-8 4-tert-Amylcyclohexanone16587-71-6 2-Undecenal2463-77-6 10-Undecyn-1-ol2774-84-7 (E)-2-Undecenal53448-07-0 4-Pentylcyclohexanone61203-83-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook