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1,4-Dithiaspiro[4.5]decan-8-ol

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Name

1,4-Dithiaspiro[4.5]decan-8-ol

EINECS N/A
CAS No. 22428-86-0 Density 1.26 g/cm3
PSA 70.83000 LogP 2.09760
Solubility N/A Melting Point 83-85℃
Formula C8H14OS2 Boiling Point 339.7 °C at 760 mmHg
Molecular Weight 190.331 Flash Point 165.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 22428-86-0 (1,4-Dithiaspiro[4.5]decan-8-ol) Hazard Symbols N/A
Synonyms

NSC 244358;8-Hydroxy-1, 4-dithiaspiro[4.5]decane;

Article Data 8

1,4-Dithiaspiro[4.5]decan-8-ol Specification

The 1, 4-Dithiaspiro[4.5]decan-8-ol, with the CAS registry number 22428-86-0, is also known as 8-Hydroxy-1, 4-dithiaspiro[4.5]decane. This chemical's molecular formula is C8H14OS2 and molecular weight is 190.33. What's more, its IUPAC name is 1, 4-Dithiaspiro[4.5]decan-8-ol.

Physical properties about 1, 4-Dithiaspiro[4.5]decan-8-ol are: (1)ACD/LogP: 1.33; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 59.83 Å2; (7)Index of Refraction: 1.616; (8)Molar Refractivity: 52.55 cm3; (9)Molar Volume: 150.2 cm3; (10)Polarizability: 20.83×10-24 cm3; (11)Surface Tension: 54 dyne/cm; (12)Density: 1.26 g/cm3; (13)Flash Point: 165.3 °C; (14)Enthalpy of Vaporization: 67.55 kJ/mol; (15)Boiling Point: 339.7 °C at 760 mmHg; (16)Vapour Pressure: 6.05E-06 mmHg at 25 °C.

Preparation of 1, 4-Dithiaspiro[4.5]decan-8-ol: this chemical is prepared by 4-Benzoyloxycyclohexanone ethylene thioacetal by heating. The reaction needs reagent aq. KOH and solvent Methanol. The reaction time is 3 hours. The yield is about 100 %.

The 1, 4-Dithiaspiro[4.5]decan-8-ol can be obtained by 4-Benzoyloxycyclohexanone ethylene thioacetal.

Uses of 1, 4-Dithiaspiro[4.5]decan-8-ol: it is used to produce other chemicals. For example, it is used to produce 1, 4-Dithia-spiro[4.5]decan-8-one. The reaction needs reagent Pyridinium dichromate and solvent Dimethylformamide. The reaction time is 12 hours with reaction temperature of 0 °C. The yield is about 67 %.

The 1, 4-Dithiaspiro[4.5]decan-8-ol can be used to produce 1, 4-Dithia-spiro[4.5]decan-8-one.

You can still convert the following datas into molecular structure:
(1) SMILES: S1C2(SCC1)CCC(O)CC2
(2) InChI: InChI=1/C8H14OS2/c9-7-1-3-8(4-2-7)10-5-6-11-8/h7,9H,1-6H2
(3) InChIKey: LAURNNUYMVKSSO-UHFFFAOYAW

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