Davanafuran

Overview IFRA Botanical Request a quote

  • Identifiers

    Molecular formula
    C13H18O2

    SMILES
    C[C@@H](C1CC[C@](O1)(C)C=C)C2=CC=CO2

    Retention indicies (RI)

    • DB5: 1414.0

  • Odor profile

    Floral 73.76%
    Green 61.8%
    Fresh 49.16%
    Herbal 46.6%
    Fruity 41.0%
    Woody 37.79%
    Sweet 37.34%
    Spicy 36.14%
    Citrus 33.38%
    Jasmin 31.68%

    Scent© AI

  • Properties

    XLogP3-AA
    2.9

    pKa est.
    7.4 (neutral)

    Molecular weight
    206.28 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    242°C

    Flash point est.
    103.78 ˚C

  • Synonyms

    • Davanafuran
    • cis-Davanafuran
    • WBNXESGNGNWXSU-VBUNGHGYSA-N

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 962.5
    methanol 946.1
    isopropanol 873.94
    water 2.25
    ethyl acetate 991.49
    n-propanol 856.21
    acetone 583.83
    n-butanol 886.02
    acetonitrile 467.11
    DMF 527.86
    toluene 789.57
    isobutanol 740.97
    1,4-dioxane 1878.46
    methyl acetate 691.57
    THF 1669.86
    2-butanone 681.63
    n-pentanol 561.39
    sec-butanol 711.89
    n-hexane 102.42
    ethylene glycol 171.02
    NMP 372.96
    cyclohexane 253.97
    DMSO 521.29
    n-butyl acetate 572.86
    n-octanol 271.75
    chloroform 2835.13
    n-propyl acetate 447.27
    acetic acid 456.77
    dichloromethane 2321.91
    cyclohexanone 813.01
    propylene glycol 275.54
    isopropyl acetate 704.27
    DMAc 731.04
    2-ethoxyethanol 765.76
    isopentanol 892.84
    n-heptane 60.19
    ethyl formate 442.07
    1,2-dichloroethane 1143.23
    n-hexanol 630.74
    2-methoxyethanol 1001.44
    isobutyl acetate 409.49
    tetrachloromethane 399.36
    n-pentyl acetate 320.55
    transcutol 2563.14
    n-heptanol 244.48
    ethylbenzene 316.98
    MIBK 509.26
    2-propoxyethanol 1001.56
    tert-butanol 971.19
    MTBE 1156.03
    2-butoxyethanol 425.46
    propionic acid 405.09
    o-xylene 373.29
    formic acid 169.9
    diethyl ether 1305.86
    m-xylene 452.17
    p-xylene 383.16
    chlorobenzene 734.8
    dimethyl carbonate 313.59
    n-octane 29.21
    formamide 220.49
    cyclopentanone 631.32
    2-pentanone 631.62
    anisole 602.93
    cyclopentyl methyl ether 804.22
    gamma-butyrolactone 707.26
    1-methoxy-2-propanol 879.82
    pyridine 945.11
    3-pentanone 510.82
    furfural 687.38
    n-dodecane 31.89
    diethylene glycol 682.72
    diisopropyl ether 373.88
    tert-amyl alcohol 720.67
    acetylacetone 676.24
    n-hexadecane 36.96
    acetophenone 442.31
    methyl propionate 612.54
    isopentyl acetate 581.7
    trichloroethylene 1825.57
    n-nonanol 249.09
    cyclohexanol 701.03
    benzyl alcohol 454.01
    2-ethylhexanol 327.92
    isooctanol 214.57
    dipropyl ether 386.3
    1,2-dichlorobenzene 616.77
    ethyl lactate 205.21
    propylene carbonate 531.4
    n-methylformamide 277.75
    2-pentanol 625.4
    n-pentane 132.35
    1-propoxy-2-propanol 622.58
    1-methoxy-2-propyl acetate 672.42
    2-(2-methoxypropoxy) propanol 497.43
    mesitylene 268.12
    ε-caprolactone 768.5
    p-cymene 167.38
    epichlorohydrin 1234.6
    1,1,1-trichloroethane 1120.72
    2-aminoethanol 385.72
    morpholine-4-carbaldehyde 753.71
    sulfolane 553.17
    2,2,4-trimethylpentane 82.74
    2-methyltetrahydrofuran 1231.54
    n-hexyl acetate 515.68
    isooctane 69.86
    2-(2-butoxyethoxy)ethanol 702.61
    sec-butyl acetate 409.31
    tert-butyl acetate 622.55
    decalin 103.62
    glycerin 326.96
    diglyme 1156.4
    acrylic acid 296.66
    isopropyl myristate 209.76
    n-butyric acid 724.75
    acetyl acetate 577.51
    di(2-ethylhexyl) phthalate 196.54
    ethyl propionate 421.27
    nitromethane 520.35
    1,2-diethoxyethane 945.53
    benzonitrile 498.63
    trioctyl phosphate 128.48
    1-bromopropane 939.7
    gamma-valerolactone 914.05
    n-decanol 183.65
    triethyl phosphate 184.17
    4-methyl-2-pentanol 405.18
    propionitrile 540.81
    vinylene carbonate 513.67
    1,1,2-trichlorotrifluoroethane 615.89
    DMS 432.8
    cumene 213.46
    2-octanol 173.08
    2-hexanone 414.86
    octyl acetate 241.25
    limonene 241.19
    1,2-dimethoxyethane 1063.05
    ethyl orthosilicate 203.4
    tributyl phosphate 177.88
    diacetone alcohol 508.06
    N,N-dimethylaniline 367.3
    acrylonitrile 474.12
    aniline 684.92
    1,3-propanediol 588.83
    bromobenzene 846.11
    dibromomethane 1538.51
    1,1,2,2-tetrachloroethane 1567.99
    2-methyl-cyclohexyl acetate 327.26
    tetrabutyl urea 202.14
    diisobutyl methanol 201.09
    2-phenylethanol 475.57
    styrene 409.31
    dioctyl adipate 257.48
    dimethyl sulfate 309.8
    ethyl butyrate 383.51
    methyl lactate 263.56
    butyl lactate 240.29
    diethyl carbonate 272.48
    propanediol butyl ether 404.22
    triethyl orthoformate 291.46
    p-tert-butyltoluene 167.03
    methyl 4-tert-butylbenzoate 350.78
    morpholine 1626.19
    tert-butylamine 733.8
    n-dodecanol 140.41
    dimethoxymethane 832.07
    ethylene carbonate 522.92
    cyrene 334.68
    2-ethoxyethyl acetate 517.91
    2-ethylhexyl acetate 443.28
    1,2,4-trichlorobenzene 681.07
    4-methylpyridine 986.91
    dibutyl ether 367.36
    2,6-dimethyl-4-heptanol 201.09
    DEF 572.44
    dimethyl isosorbide 628.18
    tetrachloroethylene 952.23
    eugenol 323.14
    triacetin 450.14
    span 80 364.88
    1,4-butanediol 272.43
    1,1-dichloroethane 1329.72
    2-methyl-1-pentanol 567.07
    methyl formate 242.7
    2-methyl-1-butanol 736.06
    n-decane 51.2
    butyronitrile 648.45
    3,7-dimethyl-1-octanol 316.99
    1-chlorooctane 209.58
    1-chlorotetradecane 92.57
    n-nonane 45.99
    undecane 38.75
    tert-butylcyclohexane 98.44
    cyclooctane 80.84
    cyclopentanol 532.37
    tetrahydropyran 1617.92
    tert-amyl methyl ether 680.46
    2,5,8-trioxanonane 781.81
    1-hexene 358.83
    2-isopropoxyethanol 576.11
    2,2,2-trifluoroethanol 183.62
    methyl butyrate 500.65

    Scent© AI

1 4

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
Davana (India) 2 8016-03-3 Artemisia pallens Wall. ex DC., fam. Asteraceae (Compositae) 0.5%