Structure

δ-Decalactone

CAS
705-86-2
Catalog Number
ACM705862
Category
Other Products
Molecular Weight
170.25g/mol
Molecular Formula
C10H18O2

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Specification

Description
Colourless to slightly yellow clear liquid; Sweet fatty peach-like aroma;colourless liquid with a coconut-fruity odour, butter-like on dilution
Synonyms
5-Decanolide, 5-Decalactone, DELTA-DECALACTONE, Decan-5-olide, Decanolide-1,5, delta-Decanolactone, ()-5-Decanolide, Amyl-delta-valerolactone, 5-Pentyl-5-pentanolide, .delta.-Amylvalerolactone, delta-Decalactone (natural), FEMA No. 2361, delta-Pentyl-delta-valerolactone, 6-Pentyltetrahydro-2H-pyran-2-one, W236101_ALDRICH, W236128_ALDRICH, 5-Hydroxydecanoic acid delta-lactone, 2H-Pyran-2-one, tetrahydro-6-pentyl-, 298069_ALDRICH, 00306_FLUKA
IUPAC Name
6-pentyloxan-2-one
Canonical SMILES
CCCCCC1CCCC(=O)O1
InChI
InChI=1S/C10H18O2/c1-2-3-4-6-9-7-5-8-10(11)12-9/h9H,2-8H2,1H3
InChI Key
GHBSPIPJMLAMEP-UHFFFAOYSA-N
Density
1.006-1.026 (20?°);0.964-0.971
Solubility
Practically insoluble or insoluble in water;Soluble (in ethanol);very soluble in alcohol and propylene glycol; insoluble in water
Complexity
143
Covalently-Bonded Unit Count
1
EC Number
211-889-1
Exact Mass
170.13068g/mol
Formal Charge
0
H-Bond Acceptor
2
H-Bond Donor
0
Heavy Atom Count
12
Monoisotopic Mass
170.13068g/mol
Refractive Index
1.449-1.459;1.456-1.459
Rotatable Bond Count
4
XLogP3
2.5

Downstream Synthesis Route 1

  • 705-86-2
  • 16425-13-1

Reference: [1]Recueil des Travaux Chimiques des Pays-Bas,1967,vol. 86,p. 481 - 503

Downstream Synthesis Route 2

  • 705-86-2
  • 16856-74-9

Reference: [1]Recueil des Travaux Chimiques des Pays-Bas,1967,vol. 86,p. 481 - 503

Downstream Synthesis Route 3

  • 705-86-2
  • 2319-29-1

Reference: [1]Archiv der Pharmazie,1960,vol. 293 /65,p. 245 - 251

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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