chempirical

5-Hexyldihydro-5-methyl-2(3H)-furanone

C11H20O2CAS 7011-83-8184.28 g/mol

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OO
EsterLactone

Properties

Molecular formula
C11H20O2
Molar mass
184.28 g/mol
Exact mass
184.1463 Da
Density
0.95 g/mL (at 20 °C)
Boiling point
120–125 °C (at NaN Torr)
logP
3.05Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
5

Identifiers

CAS number
7011-83-8
SMILES
CCCCCCC1(C)CCC(=O)O1
InChIKey
ALWUKGXLBSQSMA-UHFFFAOYSA-N
InChI
InChI=1S/C11H20O2/c1-3-4-5-6-8-11(2)9-7-10(12)13-11/h3-9H2,1-2H3

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

Names and synonyms

11 names
  • 2(3H)-Furanone, 5-hexyldihydro-5-methyl-
  • Decanoic acid, 4-hydroxy-4-methyl-, γ-lactone
  • Capric acid, γ-hydroxy-γ-methyl-, lactone
  • 4-Methyldecanolide
  • γ-Methyl-γ-decalactone
  • γ-Methyl-γ-decanolactone
  • 4-Methyl-4-decanolide
  • NSC 141822
  • Lactojamon
  • Lactojasmone
  • 5-Hexyl-5-methyldihydrofuran-2(3H)-one

Work with 5-Hexyldihydro-5-methyl-2(3H)-furanone

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

Similar compounds

Dilauroyl peroxide105-74-847 % similar Decanoic anhydride2082-76-047 % similar Palmitic anhydride623-65-447 % similar Heptanoic anhydride626-27-747 % similar Stearic anhydride638-08-447 % similar Pentaerythrityl tetrastearate115-83-345 % similar Methyl heptanoate106-73-044 % similar Methyl decanoate110-42-944 % similar

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

Same formula

2-Ethylhexyl acrylate103-11-7 γ-Undecalactone104-67-6 Citronellyl formate105-85-1 2,2,6,6-Tetramethyl-3,5-heptanedione1118-71-4 Undecylenic acid112-38-9 Octyl acrylate2499-59-4 cis-3-Hexenyl isovalerate35154-45-1 cis-3-Hexenyl valerate35852-46-1

Elsewhere

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