(Z)-3-Hexenyl 3-methylbutyrate

  • Identifiers

    CAS mumber
    35154-45-1

    Molecular formula
    C11H20O2

    SMILES
    CC/C=C\CCOC(=O)CC(C)C

    Retention indicies (RI)

    • DB5: 1231.0
    • Carbowax: 1480.0

  • Properties

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

    Molecular weight
    184.27 g/mol

    Boiling points

    • 98.00 °C. @ 15.00 mm Hg

    Solubilities

    • soluble in alcohool, most fixed oils; insolouble- water

  • Synonyms

    • cis-3-Hexenyl isovalerate
    • 35154-45-1
    • (Z)-3-Hexenyl isovalerate
    • [(Z)-hex-3-enyl] 3-methylbutanoate
    • (Z)-3-Hexen-1-yl isovalerate
    • cis-3-Hexenyl isopentanoate
    • (Z)-Hex-3-enyl isovalerate
    • (Z)-3-Hexenyl 3-methylbutyrate
    • (Z)-Hex-3-enyl 3-methylbutanoate
    • 3-Hexenyl isopentanoate
    • Hex-3-enyl isovalerate
    • cis-3-Hexenyl 3-methylbutanoate
    • cis-Hex-3-enyl 3-methylbutanoate
    • Isovaleric acid, 3-hexenyl ester
    • 3-Hexenyl 3-methylbutanoate
    • EINECS 252-404-3
    • AI3-35966
    • FEMA No. 3498
    • 3-Hexenyl isovalerate, (3Z)-
    • 3-Hexen-1-yl 3-methylbutanoate
    • (Z)-3-hexenyl 3-methylbutanoate
    • Butanoic acid, 3-methyl-, (3Z)-3-hexenyl ester
    • Butanoic acid, 3-methyl-, 3-hexenyl ester, (Z)-
    • Isovaleric acid cis-3-hexenyl ester
    • 3-Hexenyl 3-methylbutanoate, (3Z)-
    • BRN 2433447
    • Butanoic acid, 3-methyl-, (3Z)-3-hexen-1-yl ester
    • L9KN8775G8
    • EINECS 233-104-1
    • ISOVALERIC ACID, 3-HEXENYL ESTER, (Z)-
    • 3-Hexenyl isovalerate
    • (Z)-3-Hexenyl isopentanoate
    • (Z)-Hex-3-en-1-yl 3-methylbutanoate
    • (3Z)-3-Hexenyl 3-methylbutanoate
    • 3-HEXENYL ISOVALERATE, CIS-
    • CIS-3-HEXENYL-3-METHYLBUTYRATE
    • CIS-3-HEXENYL ISOVALERATE [FHFI]
    • (Z)-3-HEXENYL ISOVALERATE [FCC]
    • WE(6:1(3Z)/4:0(3Me))
    • Butanoic acid, 3-methyl-, 3-hexen-1-yl ester
    • ((Z)-hex-3-enyl) 3-methylbutanoate
    • FEMA 3498
    • UNII-L9KN8775G8
    • [(E)-hex-3-enyl] 3-methylbutanoate
    • MFCD00036533
    • 3Z-Hexenyl Isovalerate
    • cis-3-Hexenyl iso-valerate
    • (3Z)-3-hexenyl isovalerate
    • SCHEMBL573191
    • DTXSID2052029
    • AIQLNKITFBJPFO-WAYWQWQTSA-
    • CHEBI:172060
    • |cis|-3-Hexenyl 3-methylbutanoate
    • 3-Hexenyl ester(Z)-Isovaleric acid
    • LMFA07010592
    • (Z)-Hex-3-en-1-yl3-methylbutanoate
    • Isovaleric acid cis-3-hexen-1-yl ester
    • 3-Methyl-3-hexenyl ester(Z)-Butanoic acid
    • I0307
    • NS00012583
    • D91124
    • (3Z)-HEX-3-EN-1-YL 3-METHYLBUTANOATE
    • cis-3-Hexenyl 3-methylbutanoate, >=97%, FCC, FG
    • Q27282877
    • 252-404-3
    • InChI=1/C11H20O2/c1-4-5-6-7-8-13-11(12)9-10(2)3/h5-6,10H,4,7-9H2,1-3H3/b6-5-
1 3

Botanical

Name CAS Botanical Proportion
Mentha longifolia (France) 90063-99-3 Mentha longifolia (L.) Hudson, fam. Lamiaceae (Labiatae) 0.15%
Cornmint (Mentha arvensis) (India) 3 Shivalik 68917-18-0 Mentha arvensis (L.) var. piperascens Malinv., fam. Lamiaceae (Labiatae) 0.28%
Genet absolute 2 8023-80-1 Spartium junceum L., fam. Leguminosae (Papilionaceae) 0.01%
Genet headspace 2 8023-80-1 Spartium junceum L., fam. Leguminosae (Papilionaceae) 0.03%
Jasmine rose flower headspace (China) 1 Gardenia jasminoides Ellis, fam. Rubiaceae 0.88%
Cornmint (Mentha arvensis) Mongolia 68917-18-0 Mentha arvensis (L.) var. piperascens Malinv., fam. Lamiaceae (Labiatae) 0.7%
Mentha asiatica (Mongolia) Mentha asiatica Borriss, fam. Lamiaceae (Labiatae) 0.03%
Peppermint (Mongolia) 8006-90-4 Mentha piperita L., fam. Lamiaceae (Labiatae) 0.06%
Tulip sylvestre headspace cv. "Generaal de Wet" Tulipa sylvestris L. cultivar "Generaal de Wet", fam. Liliaceae 2.73%
Pelargonium sidoides Pelargonium sidoides DC., fam. Geraniaceae 0.1%
Pistacia lentiscus (Spain) 3 whole plant 90082-83-0 Pistacia lentiscus L., fam. Anacardiaceae 0.1%
Peppermint (Mexico) 8006-90-4 Mentha piperita L., fam. Lamiaceae (Labiatae) 0.1%
Rocket leaf 2 headspace Eruca sativa L., fam. Brassicaceae 5.4%
Artemisia variabilis (Italy) Artemisia variabilis Ten., fam. Asteraceae (Compositae) 0.05%
Artemisia campestris, ssp. glutinosa (Italy) Artemisia campestris L. ssp. glutinosa (Ten.) Briq. et Cavill., Asteraceae 0.1%
Mango (Cameroon) headspace of ripe fruit 90063-86-0 Mangifera indica L., fam. Anacardiaceae 2.41%