ChemicalBook > CAS DataBase List > 7,9-ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione

7,9-ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione

Health Benifits Chemical Properties

Product Name: 7,9-ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione
CAS No.: 82304-66-3
Chemical Name: 7,9-ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione
Synonyms: Oxaspiro;Rapamycin Impurity 35;Spirodiclofen Impurity 8;7,9-ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione;7,9-Di-tert-butyl-1-oxaspiro[4.5]decα-6,9-diene-2,8-dione;7,9-Di-tert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione;7,9-Di-tert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione - [D71587];1-Oxaspiro[4.5]deca-6,9-diene-2,8-dione, 7,9-bis(1,1-dimethylethyl)-
CBNumber: CB53060563
Molecular Formula: C17H24O3
Formula Weight: 276.37
MOL File: 82304-66-3.mol

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7,9-ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione Property

Melting point:: 139-140 °C
Boiling point:: 426.3±45.0 °C(Predicted)
Density: 1.06±0.1 g/cm3(Predicted)
storage temp.: Amber Vial, -20°C Freezer, Under inert atmosphere
solubility: Acetonitrile (Slightly), DMSO (Slightly), Methanol (Slightly, Heated, Sonicated)
form: Solid
color: White to Pale Yellow
Stability:: Light Sensitive
InChI: InChI=1S/C17H24O3/c1-15(2,3)11-9-17(8-7-13(18)20-17)10-12(14(11)19)16(4,5)6/h9-10H,7-8H2,1-6H3
InChIKey: ZTMZUYHXZPUDRF-UHFFFAOYSA-N
SMILES: O1C2(C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C2)CCC1=O

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Hazard and Precautionary Statements (GHS)

Symbol(GHS)

Signal word

Warning

Hazard statements

H302Harmful if swallowed

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

TRC

Product number: D493755
Product name: 7,9-Di-tert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione
Packaging: 250mg
Price: $745
Updated: 2021/12/16

Biosynth Carbosynth

Product number: FD164112
Product name: 7,9-Ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione
Packaging: 5mg
Price: $50
Updated: 2021/12/16

Biosynth Carbosynth

Product number: FD164112
Product name: 7,9-Ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione
Packaging: 10mg
Price: $95
Updated: 2021/12/16

Biosynth Carbosynth

Product number: FD164112
Product name: 7,9-Ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione
Packaging: 25mg
Price: $210
Updated: 2021/12/16

Biosynth Carbosynth

Product number: FD164112
Product name: 7,9-Ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione
Packaging: 50mg
Price: $400
Updated: 2021/12/16

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7,9-ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione Chemical Properties,Usage,Production

Health Benifits

7,9-Ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione belongs to flavonoid compound. It can be found in morels (Morchella spp.), which are among the most valuable and important mushrooms because of their taste and commercial value.

It can be identified as one of bioactive compounds in whole plant extract of Euphorbia pulcherrima, which are used in folk medicine to treat skin diseases, gonorrhea, migraine, intestinal parasites, and warts.

In addition, 7,9-ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione can also be found in marine algae, which have been highly acknowledged to possess noticeable pharmacological activities, including antineoplastic, antimicrobial and antiviral activities due to their specific functional compounds (which are not available in other plants).

Chemical Properties

7,9-Ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione (C17H24O3, CAS registry No. 82304-66-3) is an oxaspiro compound that is 1-oxaspiro[4.5]deca-6,9-diene-2,8-dione carrying two additional tert-butyl substituents at positions 7 and 9. It is an oxaspiro compound with a lactone, an enone and a cyclic ketone. Its melting point is 139-140 °C.

Uses

7,9-Di-tert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione is an antioxidant naturally found in aerial parts of Gmelina asiatica Linn (Verbenaceae). It is also found in essential oils of some Stachys species from Mediterranean area. It is an impurity of Irganox 1098 (A697523) used in the food packaging.

Definition

ChEBI: 7,9-di-tert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione is an oxaspiro compound that is 1-oxaspiro[4.5]deca-6,9-diene-2,8-dione carrying two additional tert-butyl substituents at positions 7 and 9. It is an oxaspiro compound, a lactone, an enone and a cyclic ketone.

Synthesis

65849-91-4

82304-66-3

Compound 2b (0.1 g, 0.47 mmol) was dissolved in chloroform (5 ml) and triphenylphosphine (0.13 g, 0.49 mmol) was added. The reaction mixture was stirred and the progress of the reaction was monitored by TLC until complete disappearance of the peroxide (reaction time about 10-20 min). Subsequently, p-toluenesulfonic acid (9 mg, 0.05 mmol) was added and the reaction mixture was heated to 50 °C. After 4 hours of reaction, the mixture was concentrated to dryness under reduced pressure and purified directly by column chromatography to afford the target compound 7,9-di-tert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione (0.074 g, 87% yield). The product characterization data were as follows: IR (neat, cm-1): 2957, 1774, 1647; 1H NMR (500 MHz, CDCl3): δ6.51 (s, 2H), 2.77 (t, J=8.3 Hz, 2H), 2.28 (t, J=8.3 Hz, 2H), 1.23 (s, 18H); 13C NMR ( 125 MHz, CDCl3): δ 185.5, 175.8, 147.7, 137.1, 79.9, 34.9, 33.3, 29.3, 28.6; HRMS (ESI) calculated value of C17H24O3Na [M+Na]+: 299.161762, measured value: 299.161663.

References

[1] Tetrahedron Letters, 2013, vol. 54, # 25, p. 3294 - 3297

7,9-ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione Preparation Products And Raw materials

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82304-66-3, 7,9-ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dioneRelated Search:

7,9-ditert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione

1-Oxaspiro[4.5]deca-6,9-diene-2,8-dione, 7,9-bis(1,1-dimethylethyl)-

Oxaspiro

Spirodiclofen Impurity 8

7,9-Di-tert-butyl-1-oxaspiro[4.5]decα-6,9-diene-2,8-dione

Rapamycin Impurity 35

7,9-Di<i>-tert</i>-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione

7,9-Di-tert-butyl-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione - [D71587]

82304-66-3