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1,4-Dioxaspiro[4.5]decan-8-one

Basic information Safety Supplier Related

1,4-Dioxaspiro[4.5]decan-8-one Basic information

Product Name:
1,4-Dioxaspiro[4.5]decan-8-one
Synonyms:
  • cyclohexanedione monoethylene ketal
  • 1,4-cyclohexanedione monoacetal
  • 1 4-dioxiro[4.5]decan-8-one pharmaceutical intermediate
  • Substituted 1,2,4,9-tetrahydrospiro[carbazole-3,2'-[1,3]dioxane]
  • 1,4-Cyclohexanedione monoethlylene acetal
  • 1,4-Cyclohexanedione monoethylene ketal for synthesis
  • 4-Dioxaspiro[4.5]decan-8-one
  • Cyclohexane-1,4-dione monoethylene ketal
CAS:
4746-97-8
MF:
C8H12O3
MW:
156.18
EINECS:
610-352-2
Product Categories:
  • ketone
  • Dioxanes & Dioxolanes
  • blocks
  • Carbonyl Compounds
  • Heterocycles
  • Dioxolanes
  • BuildingBlocks
  • Liquid Crystal intermediates
  • bc0001
Mol File:
4746-97-8.mol
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1,4-Dioxaspiro[4.5]decan-8-one Chemical Properties

Melting point:
70-73 °C (lit.)
Boiling point:
112C
Density 
1.0887 (rough estimate)
refractive index 
1.4430 (estimate)
storage temp. 
Keep in dark place,Inert atmosphere,Room temperature
solubility 
Soluble in chloroform & methanol.
form 
Crystalline Powder or Crystals
color 
White to beige
Sensitive 
Moisture Sensitive
BRN 
117631
InChI
InChI=1S/C8H12O3/c9-7-1-3-8(4-2-7)10-5-6-11-8/h1-6H2
InChIKey
VKRKCBWIVLSRBJ-UHFFFAOYSA-N
SMILES
O1C2(CCC(=O)CC2)OCC1
CAS DataBase Reference
4746-97-8(CAS DataBase Reference)
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Safety Information

Hazard Codes 
Xi
Risk Statements 
36/37/38
Safety Statements 
22-24/25-36/37/39-26
WGK Germany 
3
8-10-21
Hazard Note 
Irritant
HS Code 
29110000

MSDS

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1,4-Dioxaspiro[4.5]decan-8-one Usage And Synthesis

Chemical Properties

1,4-Dioxaspiro[4.5]decan-8-one is white to beige crystalline powder or crystals

Uses

1,4-Dioxaspiro[4.5]decan-8-one is used in the preparation of series of potent analgesic compounds. 1,4-Cyclohexanedione Monoethylene Acetal is also used as a building block in the synthesis of tritium labelled probes for the autoradiography study of the dopamine reuptake complex.

Uses

Intermediates of Liquid Crystals

Uses

1,4-Cyclohexanedione is used in the preparation of series of potent analgesic compounds. 1,4-Cyclohexanedione is also used as a building block in the synthesis of tritium labelled probes for the autoradiography study of the dopamine reuptake complex.

Application

1,4-Dioxaspiro[4.5]decan-8-one can be used:
(1) Used in a study of microwave-assisted reductive amination.
(2) Via a novel aromatization process, this bicyclic frame can be converted into a series of 5-alkoxytryptamine derivatives including serotonin, melatonin and bufotenin.

Purification Methods

Recrystallise it from pet ether. It sublimes slowly on attempted distillation. Also purify it by dissolving it in Et2O and adding pet ether (b 60-80o) until turbid and cooling. [Gardner et al. J Am Chem Soc 22 1206 1957, Britten & Lockwood J Chem Soc Perkin Trans 1 1824 1974.] [Beilstein 19/4 V 93.]

1,4-Dioxaspiro[4.5]decan-8-oneSupplier

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