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76231-76-0

76231-76-0 Structure

76231-76-0 Structure
IdentificationBack Directory
[Name]

ALPHA+BETA-THUJONE
[CAS]

76231-76-0
[Synonyms]

α,β-Thujone
β-thujone, 2-10%
α-thujone, 90-98%
THUJONE, (alpha, beta)-(SG)
(1S,5R)-1-Isopropyl-4-methylbicyclo[3.1.0]hexan-3-one
Bicyclo[3.1.0]hexan-3-one, 4-methyl-1-(1-methylethyl)-, (1S,5R)-
alpha,beta-Thujone technical, ~70% alpha-thujone basis, ~10% beta-thujone basis
[Molecular Formula]

C10H16O
[MDL Number]

MFCD00135597
[MOL File]

76231-76-0.mol
[Molecular Weight]

152.23
Chemical PropertiesBack Directory
[Boiling point ]

84-86 °C/17 mmHg (lit.)
[density ]

0.925 g/mL at 25 °C (lit.)
[refractive index ]

n20/D 1.455(lit.)
[Fp ]

64 °C
[storage temp. ]

2-8°C
[solubility ]

Chloroform (Slightly), Dichloromethane (Slightly), DMSO (Slightly)
[form ]

Oil
[color ]

Colourless
Safety DataBack Directory
[Hazard Codes ]

T
[Risk Statements ]

23/24/25-36/37/38-42/43
[Safety Statements ]

23-26-36/37/39-45
[RIDADR ]

UN 2810 6.1/PG 3
[WGK Germany ]

3
[Hazardous Substances Data]

76231-76-0(Hazardous Substances Data)
Hazard InformationBack Directory
[Uses]

α,β-Thujone is a component of the essential oil of Pistacia vera L. It is also used as as a reactant in organic synthesis.
[General Description]

This substance is a primary reference substance with assigned absolute purity (considering chromatographic purity, water, residual solvents, inorganic impurities). The exact value can be found on the certificate. Produced by PhytoLab GmbH & Co. KG
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