chempirical

2-Hexanoylfuran

C10H14O2CAS 14360-50-0166.22 g/mol

Open in Covalent MOL file
OO
Ketone

Properties

Molecular formula
C10H14O2
Molar mass
166.22 g/mol
Exact mass
166.0994 Da
Density
0.9954 g/mL (at 25 °C)
Boiling point
116–119 °C (at 16 Torr)
logP
3.04Crippen estimate
Polar surface area
30.2 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
5

Identifiers

CAS number
14360-50-0
SMILES
CCCCCC(=O)c1ccco1
InChIKey
YUAYWSBSIJVIBS-UHFFFAOYSA-N
InChI
InChI=1S/C10H14O2/c1-2-3-4-6-9(11)10-7-5-8-12-10/h5,7-8H,2-4,6H2,1H3

Weigh it out

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

Names and synonyms

9 names
  • 1-Hexanone, 1-(2-furanyl)-
  • 1-Hexanone, 1-(2-furyl)-
  • 1-(2-Furanyl)-1-hexanone
  • 2-Furyl pentyl ketone
  • NSC 27361
  • 2-Furyl n-pentyl ketone
  • 2-Caproylfuran
  • Pentyl 2-furyl ketone
  • 1-(2-Furyl)hexan-1-one

Work with 2-Hexanoylfuran

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

Phenylacetaldehyde dimethyl acetal101-48-4 (-)-Camphorquinone10334-26-6 Camphorquinone10373-78-1 4-Butoxyphenol122-94-1 1,4-Diethoxybenzene122-95-2 Hexahydro-2,5-methanopentalene-3A(1H)-carboxylic acid16200-53-6 4-Butylresorcinol18979-61-8 3-Butoxyphenol18979-72-1

Elsewhere

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