Thujyl alcohol

  • Identifiers

    CAS number
    21653-20-3

    Molecular formula
    C10H18O

    SMILES
    C[C@@H]1[C@H]2C[C@]2(C[C@@H]1O)C(C)C

    Retention indicies (RI)

    • Carbowax: 1574.0

  • Properties

    XLogP3-AA
    2.6 Well soluble in DEP, BB, MMB

    Molecular weight
    154.25 g/mol

    Solubilities

    • Practically insoluble to insoluble in water; soluble in non-polar solvents
    • Soluble (in ethanol)

  • Synonyms

    • (-)-Thujol
    • Thujyl alcohol
    • 21653-20-3
    • 193IW486Z8
    • (-)-3-NEOISOTHUJANOL
    • THUJOL, (-)-
    • FEMA NO. 4079
    • DTXSID80885170
    • 3-NEOISOTHUJANOL, (-)-
    • 3-Thujol
    • Bicyclo[3.1.0]hexan-3-ol, 4-methyl-1-(1-methylethyl)-, (1S,3S,4R,5R)-
    • THUJYL ALCOHOL, (1S,3S,4R,5R)-
    • Bicyclo(3.1.0)hexan-3-ol, 4-methyl-1-(1-methylethyl)-, (1S,3S,4R,5R)-
    • (1S,3S,4R,5R)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-ol
    • BICYCLO(3.1.0)HEXAN-3-OL, 4-METHYL-1-(1-METHYLETHYL)-, (1S-(1.ALPHA.,3.ALPHA.,4.ALPHA.,5.ALPHA.))-
    • (1S,3S,4R,5R)-4-methyl-1-propan-2-ylbicyclo(3.1.0)hexan-3-ol
    • (1S,3S,4R,5R)-4-Methyl-1-(1-methylethyl)bicyclo(3.1.0)hexan-3-ol
    • (1S,3S,4R,5R)-4-Methyl-1-(1-methylethyl)bicyclo[3.1.0]hexan-3-ol
    • THUJAN-4-OL [FHFI]
    • SCHEMBL3741642
    • CHEMBL3277900
    • UNII-193IW486Z8
    • DZVXRFMREAADPP-IMSYWVGJSA-N
    • DTXCID301024567
    • EINECS 244-504-0
    • NS00088853
    • Q27252064
    • Bicyclo3.1.0hexan-3-ol, 4-methyl-1-(1-methylethyl)-, (1S,3S,4R,5R)-
    • (1S-(1alpha,3alpha,4alpha,5alpha))-4-Methyl-1-(1-methylethyl)bicyclo(3.1.0)hexan-3-ol
    • BICYCLO(3.1.0)HEXAN-3-OL, 4-METHYL-1-(1-METHYLETHYL)-, (1S-(1ALPHA,3ALPHA,4ALPHA,5ALPHA))-
1 3

Botanical

Name CAS Botanical Proportion
Cedarleaf 2 8000-27-9 Thuja occidentalis L., fam. Taxodiaceae 0.3%
Ginger (Sri Lanka) 1 8007-08-7 Zingiber officinale Roscoe, fam. Zingiberaceae 0.1%
Ginger (Sri Lanka) 2 8007-08-7 Zingiber officinale Roscoe, fam. Zingiberaceae 0.4%
Ginger (Sri Lanka) 3 8007-08-7 Zingiber officinale Roscoe, fam. Zingiberaceae 0.1%
Ginger (Sri Lanka) 4 8007-08-7 Zingiber officinale Roscoe, fam. Zingiberaceae 0.5%
Dracocephalum kotschyi Dracocephalum kotschyi Boiss., fam. Lamiaceae (Labiatae) 0.5%
Wormwood (Mugwort) (India) 8008-93-3 Artemisia absinthium L., fam. Asteraceae (Compositae) 20.23%
Wormwood (Mugwort) (Spain) 1 8008-93-3 Artemisia absinthium L., fam. Asteraceae (Compositae) 0.1%
Calamintha nepeta (Greece) 2 Calamintha nepeta (L.) Savi ssp. glandulosa (Req.) P.W.Ball, fam.Lamiaceae 0.5%
Zingiber cassumunar root (Indonesia) 1 Zingiber cassumunar Roxb., fam. Zingiberaceae 0.01%
Zingiber cassumunar root (Indonesia) 2 Zingiber cassumunar Roxb., fam. Zingiberaceae 0.01%
Wormwood (Mugwort) (Germany) 8008-93-3 Artemisia absinthium L., fam. Asteraceae (Compositae) 0.05%
Cypress twig/leaf 8013-86-3 Cupressus sempervirens L. (C. fastigiata DC), fam. Cupressaceae 0.8%
Cypress fruit/cone 8013-86-3 Cupressus sempervirens L. (C. fastigiata DC), fam. Cupressaceae 3.8%
Sage, dalmatian (France) 2 8016-20-4 Salvia officinalis L., fam. Lamiaceae (Labiatae) 0.3%
Sage, dalmatian (Hungary) 3 8016-20-4 Salvia officinalis L., fam. Lamiaceae (Labiatae) 0.15%
Sage, dalmatian (Portugal) 8016-20-4 Salvia officinalis L., fam. Lamiaceae (Labiatae) 0.85%
Sage, dalmatian (Romania) 2 8016-20-4 Salvia officinalis L., fam. Lamiaceae (Labiatae) 0.4%
Sage, dalmatian (Czech Republic) 8016-20-4 Salvia officinalis L., fam. Lamiaceae (Labiatae) 1.2%
Salvia pomifera Salvia pomifera L. ssp. calycina (Sm.) Hayek, fam. Lamiaceae (Labiatae) 0.2%
Daidai (Japan) Citrus aurantium L., cultivar cyathifera Y. Tanaka, fam. Rutaceae 0.01%
Teucrium arduini (Serbia/Montenegro) Teucrium arduini L., fam. Lamiaceae (Labiatae) 0.9%
Teucrium botrys (Serbia/Montenegro) Teucrium botrys L., fam. Lamiaceae (Labiatae) 0.5%
Teucrium flavum (Serbia/Montenegro) Teucrium flavum L., fam. Lamiaceae (Labiatae) 1.1%
Teucrium montanum (Serbia/Montenegro) Teucrium montanum L., fam. Lamiaceae (Labiatae) 0.4%
Teucrium scordium (Serbia/Montenegro) 90131-54-7 Teucrium scordium L., fam. Lamiaceae (Labiatae) 0.6%