Citronellyl valerate

  • Identifiers

    CAS mumber
    7540-53-6

    Molecular formula
    C15H28O2

    SMILES
    CCCCC(=O)OCCC(C)CCC=C(C)C

  • Properties

    XLogP3-AA
    5.1 Well soluble in BB, IPM, DOA

    Molecular weight
    240.38 g/mol

    Boiling points

    • 237.00 to 240.00 °C. @ 760.00 mm Hg

  • Synonyms

    • CITRONELLYL VALERATE
    • 7540-53-6
    • Citronellyl pentanoate
    • 3,7-dimethyloct-6-enyl pentanoate
    • Pentanoic acid, 3,7-dimethyl-6-octen-1-yl ester
    • Pentanoic acid, 3,7-dimethyl-6-octenyl ester
    • 3,7-Dimethyloct-6-enyl valerate
    • FEMA No. 2317
    • UNII-43TPH8V20B
    • 3,7-Dimethyl-6-octen-1-yl valerate
    • 43TPH8V20B
    • EINECS 231-416-2
    • 3,7-dimethyloct-6-en-1-yl pentanoate
    • 3,7-Dimethyl-6-octen-1-yl pentanoate
    • AI3-24388
    • FEMA 2317
    • DTXSID00864088
    • Valeric acid, 3,7-dimethyl-6-octen-1-yl ester
    • CITRONELLYL VALERATE [FHFI]
    • (+/-)-CITRONELLYL VALERATE
    • CITRONELLYL VALERATE, (+/-)-
    • Citronellyl pentanoic acid
    • SCHEMBL310419
    • DTXCID90812639
    • CHEBI:171851
    • LMFA07010819
    • E469
    • DB-254260
    • NS00047107
    • Q27258668
1 3

Botanical

Name CAS Botanical Proportion
Geranium (China, Yunnan) 6 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 0.15%
Turmeric 4 8024-37-1 Curcuma longa L. (C. domestica Val.), fam. Zingiberaceae 2.94%
Geranium (India) 14a 8000-46-2 Pelargonium species, cultivar Bourbon, fam. Geraniaceae 0.2%
Geranium (India) 15a cv. Kunti 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, cv. Kunti, fam. Geraniaceae 0.3%
Geranium (India) 15b cv. Kunti variant 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, cv.Kunti variant, fam. Geraniace 0.1%