Neryl 3-methylbutanoate

  • Identifiers

    CAS mumber
    3915-83-1

    Molecular formula
    C15H26O2

    SMILES
    CC(C)CC(=O)OC/C=C(/C)\CCC=C(C)C

    Retention indicies (RI)

    • Carbowax: 1890.33

  • Properties

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

    Molecular weight
    238.37 g/mol

    Boiling points

    • 145.00 °C. @ 15.00 mm Hg

    Solubilities

    • insoluble in water
    • 1 ml in 8 ml 80% alcohol (in ethanol)

  • Synonyms

    • Neryl isovalerate
    • 3915-83-1
    • Neryl isovalerianate
    • Nerol isovalerate
    • Neryl 3-methylbutanoate
    • Neryl 3-methylbutyrate
    • FEMA No. 2778
    • (Z)-Geranyl isovalerate
    • Neryl beta-methylbutyrate
    • Isovaleric acid neryl ester
    • [(2Z)-3,7-dimethylocta-2,6-dienyl] 3-methylbutanoate
    • UNII-5RC970J93J
    • 5RC970J93J
    • EINECS 223-478-4
    • Neryl .beta.-methyl butyrate
    • Isovaleric acid, 3,7-dimethyl-2,6-octadienyl ester, (Z)-
    • NERYL ISOVALERATE [FHFI]
    • FEMA 2518
    • DTXSID80884022
    • 3,7-Dimethyl-2,6-octadienyl isovalerate, (Z)-
    • 3,7-Dimethyl-2-cis-6-octadien-1-yl isovalerate
    • Butanoic acid, 3-methyl-, 3,7-dimethyl-2,6-octadienyl ester, (Z)-
    • Butanoic acid, 3-methyl-, (2Z)-3,7-dimethyl-2,6-octadien-1-yl ester
    • 3,7-Dimethyl-2,6-octadien-1-yl isopentanoate, cis-
    • 3,7-Dimethyl-2,6-octadienyl 3-methylbutanoate, (Z)-
    • 3,7-Dimethyl-2,6-octadienyl 3-methylbutanoate, cis-
    • 2,6-OCTADIEN-1-OL, 3,7-DIMETHYL-, ISOVALERATE, (Z)-
    • 3,7-Dimethyl-isovalerate(E)-2,6-Octadien-1-ol
    • (Z)-3,7-Dimethyl-2,6-octadienyl 3-methylbutanoate
    • WE(8:2(2Z,6E)(3Me,7Me)/4:0(3Me))
    • (2E)-3,7-Dimethyl-2,6-octadienyl 3-methylbutanoate
    • 3,7-Dimethyl-2,6-octadienyl ester(E)-Isovaleric acid
    • ((2Z)-3,7-DIMETHYLOCTA-2,6-DIENYL) 3-METHYLBUTANOATE
    • Neryl beta-methyl butyrate
    • Fema 2778
    • Neryl isovalerate, >=92%
    • Geranyl 3-methylbutanoic acid
    • SCHEMBL1532537
    • DTXCID501023496
    • Butanoic acid, 3-methyl-, (2Z)-3,7-dimethyl-2,6-octadienyl ester
    • LMFA07010625
    • Q27262779
    • (Z)-3,7-Dimethyl-2,6-octadienyl 3-methylbutanoic acid
    • (Z)-3,7- DIMETHYL-2,6-OCTADIEN-1-YL 3-METHYL BUTANOATE
    • (Z)-3,7-DIMETHYL-2,6-OCTADIEN-1-YL 3-METHYL BUTANOATE
    • CIS-3,7- DIMETHYL-2,6-OCTADIEN-1-YL 3-METHYL BUTANOATE
    • CIS-3,7-DIMETHYL-2,6-OCTADIEN-1-YL 3-METHYL BUTANOATE
    • 223-478-4
1 3

Botanical

Name CAS Botanical Proportion
Wormwood (Mugwort) 1 8008-93-3 Artemisia absinthium L., fam. Asteraceae (Compositae) 2.1%
Wormwood (Mugwort) (Italy) 1 8008-93-3 Artemisia absinthium L., fam. Asteraceae (Compositae) 2.0%
Helichrysum italicum 1a 8023-95-8 Helichrysum italicum (Roth) G. Don ssp. italicum, fam. Asteraceae 0.18%