3-Hexenyl benzoate, (3Z)-

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    25152-85-6

    Molecular formula
    C13H16O2

    SMILES
    CC/C=C\CCOC(=O)C1=CC=CC=C1
    OO

    Retention indicies (RI)

    • DB5: 1571.14
    • Carbowax: 2132.25

  • Odor profile

    green 94.71%
    floral 76.52%
    balsamic 74.6%
    herbal 69.01%
    sweet 62.25%
    fresh 60.18%
    woody 59.02%
    leafy 54.0%
    cortex 43.56%
    vegetable 39.52%

    Scent© AI

  • Properties

    XLogP3-AA
    4.0 Well soluble in BB, DEP, IAA

    Molecular weight
    204.26 g/mol

    Vapor pressure est.

    • 0.0016 hPa @ 20°C
    • 0.0028 hPa @ 25°C

    Evaporation rate
    Very slow

    Boiling point

    • 105.00 °C. @ 1.00 mm Hg

    Solubility expt.

    • insoluble in water; soluble in organic solvents, fats, oils
    • miscible at room temperature (in ethanol)

  • Synonyms

    • cis-3-Hexenyl benzoate
    • 25152-85-6
    • (3Z)-Hex-3-en-1-yl benzoate
    • FEMA No. 3688
    • (Z)-3-Hexenyl benzoate
    • 3-Hexenyl benzoate, (Z)-
    • 3-Hexen-1-ol, benzoate, (Z)-
    • [(Z)-hex-3-enyl] benzoate
    • (Z)-Hex-3-en-1-yl benzoate
    • 3-Hexenyl benzoate, cis-
NaN -Infinity

IFRA Standard 51

Recommendation
No restriction
Maximum acceptable concentrations in the finished product (%)
Category 1
Products applied to the lips
 No restriction Category 7A
Rinse-off products applied to the hair with some hand contact
 No restriction
Category 2
Products applied to the axillae
 No restriction Category 7B
Leave-on products applied to the hair with some hand contact
 No restriction
Category 3
Products applied to the face/body using fingertips
 No restriction Category 8
Products with significant anogenital exposure
 No restriction
Category 4
Products related to fine fragrance
 No restriction Category 9
Products with body and hand exposure, primarily rinse off
 No restriction
Category 5A
Body lotion products applied to the body using the hands (palms), primarily leave on
 No restriction Category 10A
Household care products with mostly hand contact
 No restriction
Category 5B
Face moisturizer products applied to the face using the hands (palms), primarily leave on
 No restriction Category 10B
Household care products with mostly hand contact, including aerosol/spray products (with potential leave-on skin contact)
 No restriction
Category 5C
Hand cream products applied to the hands using the hands (palms), primarily leave on
 No restriction Category 11A
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
 No restriction
Category 5D
Baby Creams, baby Oils and baby talc
 No restriction Category 11B
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
 No restriction
Category 6
Products with oral and lip exposure
 No restriction Category 12
Products not intended for direct skin contact, minimal or insignificant transfer to skin
 No restriction

Botanical

Name CAS Botanical Proportion
False acacia headspace (Black locust) Robinia pseudoacacia L. (False acacia) (Black locust), fam. Leguminosae 0.5%
Freesia, Picked Flower Headspace Freesia refracta L. 0.1%
Honeysuckle headspace Lonicera caprifoleum L., fam. Caprifoliaceae 0.1%
Jasmine absolute 8022-96-6 Jasminum officinale var. grandiflorum L., fam. Oleaceae 1.25%
Jasmine (Indonesia) 8022-96-6 Jasminum officinale var. grandiflorum L. (Red Flower), fam. Oleaceae 1.1%
Jasmine sambac (China) concrete Jasminum sambac (L.) Aiton, fam. Oleaceae 10.0%
Jasmine sambac (Indonesia) Jasminum sambac (L.) Aiton, fam. Oleaceae 2.27%
Jasmine sambac (Malati) concrete Jasminum sambac (L.) Aiton, fam. Oleaceae 5.0%
Jasmine sambac (Sampaquita) concrete Jasminum sambac (L.) Aiton (Sampaquita), fam. Oleaceae 2.0%
Narcissus tazetta absolute 2 8023-75-4 Narcissus tazetta L., fam. Amaryllidaceae 0.1%
Seringat headspace Philadelphus coronarius L., fam. Oleaceae 0.1%
Apple flower Malus arnoldiana (Rehd) Sarg. var. Redgold, fam. Rosaceae 0.01%
Hedychium coronarium flower (Japan) Hedychium coronarium Koenig, fam. Zingiberaceae 0.11%
Pistacia chinensis (Egypt) leaf Pistacia chinensis Bunge, fam. Anacardiaceae 0.7%
Pistacia khinjuk (Egypt) leaf Pistacia khinjuk Stocks, fam. Anacardiaceae 2.0%
Pistacia lentiscus (Egypt) leaf 90082-83-0 Pistacia lentiscus L., fam. Anacardiaceae 0.5%
Narcissus (Japan) 1b 8023-75-4 Narcissus tazetta L. (N. poeticus L.), fam. Amaryllidaceae 0.17%
Jasmine absolute (Algeria) 8022-96-6 Jasminum officinale var. grandiflorum L., fam. Oleaceae 2.49%
Jasmine absolute (Egypt) 1 8022-96-6 Jasminum officinale var. grandiflorum L., fam. Oleaceae 2.4%
Jasmine absolute (France) 1 8022-96-6 Jasminum officinale var. grandiflorum L., fam. Oleaceae 2.64%
Jasmine absolute (Italy) 1 8022-96-6 Jasminum officinale var. grandiflorum L., fam. Oleaceae 2.76%
Jasmine absolute (Egypt) 3 8022-96-6 Jasminum officinale var. grandiflorum L., fam. Oleaceae 4.0%
Jasmine absolute (Japan) 8022-96-6 Jasminum officinale var. grandiflorum L., fam. Oleaceae 0.01%
Lilac, White, Picked Flower Headspace 1 Syringa vulgaris L., fam. Oleaceae 0.08%
Hyacinth, picked flower headspace 1b Hyacinthus orientalis L., fam. Liliaceae 0.01%
Jasmine sambac headspace Jasminum sambac (L.) Aiton, fam. Oleaceae 2.9%
Genet absolute 2 8023-80-1 Spartium junceum L., fam. Leguminosae (Papilionaceae) 0.01%
Daphne tangutica flower concrete (China) Daphne tangutica Maxim., fam. Thymelaeaceae 0.61%
Jasmine rose flower headspace (China) 1 Gardenia jasminoides Ellis, fam. Rubiaceae 0.31%
Jasmine (China) 1 8022-96-6 Jasminum officinale var. grandiflorum L., fam. Oleaceae 0.5%
Jasmine absolute (Egypt) 4 8022-96-6 Jasminum officinale var. grandiflorum L., fam. Oleaceae 1.31%
Jasmine sambac (France) concrete Jasminum sambac (L.) Aiton, fam. Oleaceae 1.6%
Nepeta viscida (Turkey) Nepeta viscida Boiss., fam. Lamiaceae (Labiatae) 0.44%
Honeysuckle, japanese Lonicera japonica L., fam. Caprifoliaceae 0.4%
Mandarin leaf (Petitgrain mandarin.) (Italy) Citrus reticulata Blanco (C. deliciosa Tenore), fam. Rutaceae 0.01%
Orange leaf, sweet (Italy) 1 Citrus sinensis (L.) Osbeck, fam. Rutaceae 0.01%
Orange leaf, sweet (Italy) 2a Valencia Late Citrus sinensis (L.) Osbeck, cultivar Valencia late, fam. Rutaceae 0.01%
Orange leaf, sweet (Italy) 2b Biondo Comune Citrus sinensis (L.) Osbeck, cultivar Biondo Comune, fam. Rutaceae 0.01%
Orange leaf, sweet (Italy) 2c Moro Citrus sinensis (L.) Osbeck, cultivar Moro, fam. Rutaceae 0.01%
Sideritis condensata Sideritis condensata Boiss. et Heldr., fam. Lamiaceae (Labiatae) 0.04%
Jasmine rose absolute (India) Gardenia jasminoides Ellis, fam. Rubiaceae 0.23%
Tulip sylvestre Tulipa sylvestris L., fam. Liliaceae 0.01%
Solanum stuckertii flower Solanum stuckertii Bitter, fam. Solanaceae 0.21%
Solanum incisum flower Solanum incisum Griseb., fam. Solanaceae 0.1%
Guava fruit (Reunion island) 91770-12-6 Psidium guajava L., fam. Myrtaceae 0.1%
Couroupita guianensis flower (Brazil) Couroupita guainensis Auble., fam. Lecythidaceae 0.1%
Eschweilera coriacea flower Eschweilera coriacea (A.P.DC.) Mori, fam. Lecythidaceae 0.8%
Pistacia lentiscus (Spain) 3 whole plant 90082-83-0 Pistacia lentiscus L., fam. Anacardiaceae 0.1%
Nepeta betonicifolia (Turkey) Nepeta betonicifolia C.A. Meyer, fam. Lamiaceae (Labiatae) 0.1%
Inula verbascifolia ssp. parnassica Inula verbascifolia Hausskn., ssp. parnassia Tutin, fam. Asteraceae 4.4%