α- Thujene
| Compound Structure: |
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| Synonyms: | (+)-alpha-thujene;thujiene;alpha-Thujene, (+)-;alpha-Thujene, (+/-)-;Origanene;(1S,5R)-5-isopropyl-2-methylbicyclo[3.1.0]hex-2-ene;(1S)-2-Methyl-5-(1-methylethyl)bicyclo(3.1.0)hex-2-ene;Bicyclo(3.1.0)hex-2-ene, 2-methyl-5-(1-methylethyl)-, (1S) | ||||||||||||||||||||||||||||||||||||||
| Compound ID: | NMPC-607 | ||||||||||||||||||||||||||||||||||||||
| PubChem ID: | |||||||||||||||||||||||||||||||||||||||
| Molecular Formula: | C10H16 | ||||||||||||||||||||||||||||||||||||||
| Canonical SMILES: | CC1=CCC2(C1C2)C(C)C | ||||||||||||||||||||||||||||||||||||||
| InChIKey: | KQAZVFVOEIRWHN-UWVGGRQHSA-N | ||||||||||||||||||||||||||||||||||||||
| About the compound: | Terpinolene is a p-menthadiene compound with specific double bonds at positions 1 and 4(8) within its structure. It is known for its various roles and characteristics. Here are some key points about terpinolene: Physical Characteristics: Terpinolene is typically a water-white to light amber colored liquid. It is insoluble in water, and its density is lower than that of water. Industrial Uses: Terpinolene is used in industrial applications to manufacture plastics and resins. It contributes to the production of various materials. Chemical Structure: Terpinolene is classified as a p-menthadiene due to the arrangement of its double bonds at positions 1 and 4(8). This structural configuration is characteristic of terpinolene. Roles and Properties: Sedative: Terpinolene is known for its sedative properties, which means it can have a calming or tranquilizing effect. Insect Repellent: It also serves as an insect repellent, helping to deter insects. Plant Metabolite: Terpinolene is found in various plants and is considered a natural metabolite in these organisms. Volatile Oil Component: It is a component of volatile oils, contributing to the aromatic properties of certain plants and essential oils. GHS Hazard Statements • H226 (76.35%): Flammable liquid and vapor [Warning Flammable liquids] • H304 (98.07%): May be fatal if swallowed and enters airways [Danger Aspiration hazard] • H315 (57.08%): Causes skin irritation [Warning Skin corrosion/irritation] • H317 (76.39%): May cause an allergic skin reaction [Warning Sensitization, Skin] • H400 (20.21%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard] • H410 (20.34%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard] • H411 (79.74%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard] |
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| Properties: |
Chemical
and Physical Properties Computed
Properties
Source: PubChem |
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| Source Species: |
Tetrapleura tetraptera Tithonia diversifolia Eremomastax speciosa Eucalyptus cloeziana Brachystegia eurycoma Eucalyptus tereticornis Tagetes erecta Pyrenacantha staudtii |