• Identifiers

    CAS mumber
    105-85-1

    Molecular formula
    C11H20O2

    SMILES
    CC(CCC=C(C)C)CCOC=O

    Retention indicies (RI)

    • DB5: 1279.0
    • Carbowax: 1603.0
  • Properties

    XLogP3-AA
    3.8 Well soluble in BB, DEP, IPM

    Molecular weight
    184.27 g/mol

    Boiling points

    • 235.00 °C. @ 760.00 mm Hg

    Solubilities

    • soluble in alcohol, most fixed oils; slightly soluble in propylene glycol; insoluble in glycerin, water
    • 1 ml in 3 ml 80% alcohol remains in soln to 10 ml (in ethanol)

  • Synonyms

    • Citronellyl formate
    • 105-85-1
    • 3,7-dimethyloct-6-en-1-yl formate
    • 6-OCTEN-1-OL, 3,7-DIMETHYL-, FORMATE
    • Formic acid, citronellyl ester
    • Citronellyl methanoate
    • 3,7-dimethyloct-6-enyl formate
    • Citronellol formate
    • 2,6-Dimethyl-2-octen-8-yl formate
    • 3,7-Dimethyl-6-octen-1-yl formate
    • FEMA No. 2314
    • (1)-3,7-Dimethyloct-6-enyl formate
    • 3,7-Dimethyl-6-octen-1-yl methanoate
    • Formic acid, 3,7-dimethyl-6-octen-1-yl ester
    • 7B1MY2BRDK
    • 93919-91-6
    • EINECS 203-338-9
    • EINECS 300-075-2
    • NSC 46117
    • BRN 1723215
    • DTXSID1044772
    • AI3-24239
    • 6-Octen-1-ol, 3,7-dimethyl-, 1-formate
    • NSC-46117
    • (+)-3,7-Dimethyloct-6-enyl formate
    • (-)-3,7-Dimethyloct-6-enyl formate
    • DTXCID9024772
    • CHEBI:31406
    • CITRONELLYL FORMATE [FCC]
    • CITRONELLYL FORMATE [FHFI]
    • (+/-)-CITRONELLYL FORMATE
    • 2-02-00-00032 (Beilstein Handbook Reference)
    • CITRONELLYL FORMATE, (+/-)-
    • 93919-93-8
    • UNII-7B1MY2BRDK
    • Citronellol formate (6CI)
    • Citronelyl formate
    • EINECS 300-076-8
    • EINECS 300-078-9
    • Citronellyl formate, FCC
    • SCHEMBL416782
    • CHEMBL3184928
    • FEMA 2314
    • WLN: VHO2Y1&3UY1&1
    • NSC46117
    • 3,7-Dimethyl-6-octenyl formate #
    • Tox21_301031
    • 6-Octen-1-ol,7-dimethyl-, formate
    • AKOS016009786
    • 2, 6-Dimethyl-2-octen-8-yl formate
    • LMPR0102010014
    • NCGC00248262-01
    • NCGC00254933-01
    • 6-Octen-1-ol,3,7-dimethyl-,1-formate
    • AS-62928
    • CAS-105-85-1
    • Formic acid,7-dimethyl-6-octen-1-yl ester
    • CS-0186751
    • NS00012114
    • F88176
    • Q27114304
    • 203-338-9
1 of 3
Name CAS Botanical Proportion
Bergamot (China) 1 8007-75-8 Citrus bergamia Risso et Poiteau, fam. Rutaceae 0.02%
Blackcurrant bud, absolute 68606-81-5 Ribes nigrum L., fam. Grossulariaceae 0.17%
Fissitigma shangtzeense, flower extract Fissitigma shangtzeense Tsiang et P.T. Li, fam. Annonaceae 0.05%
Geranium (Algeria) 1 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 9.4%
Geranium (Algeria) 2 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 7.57%
Geranium, Bourbon 1 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 12.39%
Geranium, Bourbon 3 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 7.75%
Geranium, Bourbon 5 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 10.17%
Geranium, Bourbon 4 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 7.94%
Geranium, Bourbon 2 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 8.37%
Geranium (China) 1 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 17.45%
Geranium (China) 2 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 11.35%
Geranium (China, Yunnan) 1 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaciae 11.73%
Geranium (China, Yunnan) 2 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 8.22%
Geranium (China, Yunnan) 3 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 10.81%
Geranium (China, Yunnan) 4 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 11.78%
Geranium (Egypt) 1 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 7.43%
Geranium (Egypt) 2 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 6.74%
Geranium (Morocco) 1 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 7.64%
Geranium (Morocco) 2 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 6.02%
Lovage headspace 8016-31-7 Levisticum officinale Koch, fam. Apiaceae (Umbelliferae) 1.34%
Skimmia laureola (India) 1 Skimmia laureola Sieb. et Zucc., fam. Rutaceae 0.65%
Rosa rugosa Rosa rugosa Thunb., var. plena Regel, fam. Rosaceae 0.09%
Mandarin leaf (Petitgrain mandarin.) (Israel) 5 Citrus reticulata Blanco, cultivar Clementine, Rutaceae 2.56%
Mandarin leaf (Petitgrain mandarin.) (Israel) 6 Citrus reticulata Blanco, cultivar Michal, fam. Rutaceae 0.65%
Mandarin leaf (Petitgrain mandarin.) (Israel) 7 Citrus reticulata Blanco, cultivar Nectarine, fam. Rutaceae 0.01%
Geranium (China, Yunnan) 6 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 7.71%
Geranium (Rwanda) 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 0.05%
Geranium (India) 3 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 1.14%
Geranium, Bourbon 8 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 7.88%
Geranium (India) 4 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 9.0%
Geranium (India) 5 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 8.21%
Geranium (India) 6 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 7.64%
Geranium (India) 7 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 4.84%
Geranium, Bourbon 9 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 4.3%
Mandarin (Italy) 5 8008-31-9 Citrus deliciosa Tenore (C. reticulata Blanco, cv.mandarin), fam. Rutaceae 0.01%
Geranium, Bourbon 6 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 12.39%
Geranium, Bourbon 7 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 7.2%
Geranium 2 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 8.4%
Geranium (China) 3 8000-46-3 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 11.5%
Geranium (Egypt) 3 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 7.0%
Geranium 1 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 7.88%
Geranium, Bourbon 10 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 7.8%
Geranium (Madagascar) 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 7.9%
Geranium (India) 8 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 7.35%
Geranium (Egypt) 4 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 6.71%
Geranium (China, Yunnan) 5 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 11.84%
Geranium (China, Beijing) 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 12.23%
Geranium (China, Chengdu) 8000-46-2 Pelargonium graveolens L'Herit. ex Aiton, fam. Geraniaceae 9.79%
Vassoura (Brazil) 2 Baccharis dracunculifolia DC., fam. Asteraceae (Compositae) 0.01%