trans-Isopulegone

  • Identifiers

    CAS mumber
    29606-79-9

    Molecular formula
    C10H16O

    SMILES
    CC1CCC(C(=O)C1)C(=C)C

    Retention indicies (RI)

    • Carbowax: 1580.0

  • Properties

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

    Molecular weight
    152.23 g/mol

    Boiling points

    • 101.00 to 102.00 °C. @ 17.00 mm Hg

    Solubilities

    • slightly
    • insoluble in water; soluble in alcohol and oils
    • miscible (in ethanol)

  • Synonyms

    • Isopulegone
    • 5-methyl-2-prop-1-en-2-ylcyclohexan-1-one
    • 529-00-0
    • Cyclohexanone, 5-methyl-2-(1-methylethenyl)-
    • p-menth-8-en-3-one
    • 29606-79-9
    • 5-methyl-2-(prop-1-en-2-yl)cyclohexan-1-one
    • 2-Isopropenyl-5-methylcyclohexanone #
    • (-)-trans-Isopulegone
    • SCHEMBL727954
    • CHEBI:37046
    • DTXSID40865498
    • (-)-trans-p-Menth-8-en-3-one
    • SAA88243
    • AKOS015907574
    • Cyclohexanone, 2-isopropylideno-5-methyl-
    • 5-methyl-2-(prop-1-en-2-yl)cyclohexanone
    • NS00096354
    • EN300-2968121
    • Q27117020
    • (2R-trans)-5-methyl-2-(1-methylethenyl)-cyclohexanone
1 3

Botanical

Name CAS Botanical Proportion
Celery seed (China) 1 8015-90-5 Apium graveolens L., fam. Apiaceae (Umbelliferae) 0.16%
Mentha cervina Mentha cervina L., fam. Lamiaceae (Labiatae) 1.0%
Mentha gentilis var. lanata Mentha gentilis (L.) var. lanata (Rydb.) Fujita et Fujita, fam. Lamiaceae 1.4%
Mentha rotundifolia (Greece) 1 Mentha x rotundifolia (L.) Hudson (Chemotype I), fam. Lamiaceae (Labiatae) 1.7%
Mentha spicata (Greece) Chemotype IIIb Mentha spicata L. (Chemotype IIIb), fam. Lamiaceae (Labiatae) 0.1%
Mentha spicata (Greece) Chemotype IV Mentha spicata L. (Chemotype IV), fam Lamiaceae (Labiatae) 8.8%
Mentha x dumetorum (Greece) Mentha x dumetorum, fam Lamiaceae (Labiatae) 2.4%
Mentha x villosa (Greece) 1 Mentha x villosa Hudson, fam. Lamiaceae (Labiatae) 0.1%
Mentha x villosa (Greece) 2 Mentha x villosa Hudson, fam. Lamiaceae (Labiatae) 0.18%
Minthostachys andina Minthostachys andina (Brett) Epling, fam. Lamiaceae (Labiatae) 4.93%
Pennyroyal 1 8013-99-8 Mentha pulegium L., fam. Lamiaceae (Labiatae) 0.9%
Pennyroyal 3 8013-99-8 Mentha pulegium L., fam. Lamiaceae (Labiatae) 0.75%
Mentha arvensis, Glabrata Ray variety Mentha arvensis (L.) var. glabrata Ray, fam. Lamiaceae (Labiatae) 1.35%
Acinos suaveolens (Turkey) Acinos suaveolens (Sibt. et Smith) G. Don f., fam. Lamiaceae (Labiatae) 0.58%
Ziziphora tenuior (Turkey) Ziziphora tenuior L.(Z.acutifolia Montbret & Aucher ex Bentham), Lamiaceae 0.34%
Calamintha arkansana Calamintha arkansana (Nutt.) Shinners, fam. Lamiaceae (Labiatae) 0.4%
Eromenthe (USA) 1 Mentha spicata L., var. eromenthe, fam. Lamiaceae (Labiatae) 0.5%
Buchu leaf (South Africa) 1a 84649-93-4 Agathosma betulina (Berg.) Pillans (Barosma betulina Bertl.), fam. Rutacea 0.54%
Buchu leaf (South Africa) 1b (species) 84649-93-4 Agathosma crenulata Pillans, fam. Rutaceae 2.77%
Buchu leaf (South Africa) 1c (hybrid) 84649-93-4 Agathosma betulina x crenulata, fam. Rutaceae 1.53%
Buchu leaf (South Africa) 2 84649-93-4 Agathosma betulina (Berg.) Pillans (Barosma betulina Bertl.), fam. Rutacea 1.36%
Pennyroyal (USA) 8013-99-8 Mentha pulegium L., fam. Lamiaceae (Labiatae) 0.3%
Pennyroyal (Germany) 1a 8013-99-8 Mentha pulegium L., fam. Lamiaceae (Labiatae) 0.6%
Pennyroyal (Germany) 1b 8013-99-8 Mentha pulegium L., fam. Lamiaceae (Labiatae) 0.01%
Pennyroyal (Germany) 1c 8013-99-8 Mentha pulegium L., fam. Lamiaceae (Labiatae) 0.01%
Pennyroyal (Greece) 8013-99-8 Mentha pulegium L., fam. Lamiaceae (Labiatae) 0.3%
Thymus migricus (Turkey) Thymus migricus Klokov et Des.-Shost., fam. Lamiaceae (Labiatae) 0.05%