Calendoflaside

Overview IFRA Request a quote

  • Identifiers

    CAS number
    121064-69-5

    Molecular formula
    C28H32O15

    SMILES
    C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@@H]([C@H]([C@@H](O[C@H]2OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)OC)C)O)O)O)O)O

    Safety labels

  • Odor profile

    Fragrance
    Odorless 75.19%
    Vanilla 36.37%
    Phenolic 26.65%
    Milky 25.15%
    Savory 22.64%
    Sweet 22.6%
    Burnt 22.45%
    Creamy 21.37%
    Smoky 20.9%
    Caramellic 19.13%

     

    Flavor
    Bitter 72.23%
    Bland 33.79%
    Odorless 32.86%
    Sweet-like 27.21%
    Cedarleaf 20.49%
    Eugenol 20.1%
    Parsley 20.02%
    Very mild 19.56%
    Lovage 19.22%
    Very slight 19.18%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    0.1

    pKa est.
    7.6 (neutral)

    Molecular weight
    608.5 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    4964°C

    Flash point

    • 261.49 ˚C est.

  • Synonyms

    • Calendoflaside
    • 121064-69-5
    • RefChem:331603
    • DTXSID201317307
    • 5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-1-benzopyran-3-yl 6-deoxy-2-O-(6-deoxy-alpha-L-mannopyranosyl)-alpha-L-mannopyranoside
    • 121064-69-5

  • Applications

    Calendoflaside, CAS 121064-69-5, is a plant-derived glycoside that is commonly evaluated as a botanical extract component with potential antioxidant properties and may serve as a natural colorant or fragrance-related constituent in formulations; in industry contexts its potential applications include cosmetics and personal care as an active ingredient or preservative additive, fragrance and perfumery as a natural fragrance constituent or fixative, pharmaceutical research as a botanical lead compound or excipient, and as an intermediate or additive in organic synthesis or chemical manufacturing, with potential exploration in polymer or coatings formulations as a natural additive, all subject to regulatory constraints.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1.19
    methanol 4.77
    isopropanol 0.56
    water 0.06
    ethyl acetate 0.14
    n-propanol 1.54
    acetone 0.3
    n-butanol 0.76
    acetonitrile 0.09
    DMF 9.01
    toluene 0.03
    isobutanol 0.44
    1,4-dioxane 2.74
    methyl acetate 0.4
    THF 3.15
    2-butanone 0.62
    n-pentanol 0.37
    sec-butanol 0.75
    n-hexane 0.0
    ethylene glycol 5.45
    NMP 15.92
    cyclohexane 0.01
    DMSO 13.32
    n-butyl acetate 0.1
    n-octanol 0.27
    chloroform 0.11
    n-propyl acetate 0.1
    acetic acid 5.12
    dichloromethane 0.17
    cyclohexanone 0.87
    propylene glycol 7.79
    isopropyl acetate 0.08
    DMAc 11.66
    2-ethoxyethanol 4.83
    isopentanol 0.29
    n-heptane 0.01
    ethyl formate 0.39
    1,2-dichloroethane 0.14
    n-hexanol 0.16
    2-methoxyethanol 15.39
    isobutyl acetate 0.04
    tetrachloromethane 0.02
    n-pentyl acetate 0.27
    transcutol 6.99
    n-heptanol 0.33
    ethylbenzene 0.01
    MIBK 0.09
    2-propoxyethanol 2.87
    tert-butanol 0.24
    MTBE 0.11
    2-butoxyethanol 2.65
    propionic acid 1.98
    o-xylene 0.03
    formic acid 12.13
    diethyl ether 0.18
    m-xylene 0.02
    p-xylene 0.01
    chlorobenzene 0.02
    dimethyl carbonate 0.58
    n-octane 0.0
    formamide 8.23
    cyclopentanone 1.64
    2-pentanone 0.26
    anisole 0.07
    cyclopentyl methyl ether 0.33
    gamma-butyrolactone 2.72
    1-methoxy-2-propanol 6.88
    pyridine 0.76
    3-pentanone 0.22
    furfural 2.7
    n-dodecane 0.0
    diethylene glycol 5.21
    diisopropyl ether 0.02
    tert-amyl alcohol 0.39
    acetylacetone 0.34
    n-hexadecane 0.0
    acetophenone 0.13
    methyl propionate 0.47
    isopentyl acetate 0.08
    trichloroethylene 0.25
    n-nonanol 0.28
    cyclohexanol 0.4
    benzyl alcohol 0.27
    2-ethylhexanol 0.07
    isooctanol 0.17
    dipropyl ether 0.12
    1,2-dichlorobenzene 0.02
    ethyl lactate 0.52
    propylene carbonate 0.55
    n-methylformamide 4.93
    2-pentanol 0.25
    n-pentane 0.01
    1-propoxy-2-propanol 1.43
    1-methoxy-2-propyl acetate 0.45
    2-(2-methoxypropoxy) propanol 1.83
    mesitylene 0.01
    ε-caprolactone 1.22
    p-cymene 0.01
    epichlorohydrin 2.26
    1,1,1-trichloroethane 0.02
    2-aminoethanol 6.18
    morpholine-4-carbaldehyde 14.5
    sulfolane 8.65
    2,2,4-trimethylpentane 0.0
    2-methyltetrahydrofuran 0.78
    n-hexyl acetate 0.32
    isooctane 0.0
    2-(2-butoxyethoxy)ethanol 3.04
    sec-butyl acetate 0.05
    tert-butyl acetate 0.08
    decalin 0.0
    glycerin 21.37
    diglyme 4.76
    acrylic acid 3.44
    isopropyl myristate 0.06
    n-butyric acid 0.98
    acetyl acetate 0.09
    di(2-ethylhexyl) phthalate 0.17
    ethyl propionate 0.1
    nitromethane 3.59
    1,2-diethoxyethane 0.49
    benzonitrile 0.06
    trioctyl phosphate 0.15
    1-bromopropane 0.05
    gamma-valerolactone 8.92
    n-decanol 0.16
    triethyl phosphate 0.1
    4-methyl-2-pentanol 0.07
    propionitrile 0.13
    vinylene carbonate 0.59
    1,1,2-trichlorotrifluoroethane 8.3
    DMS 0.3
    cumene 0.01
    2-octanol 0.16
    2-hexanone 0.15
    octyl acetate 0.17
    limonene 0.02
    1,2-dimethoxyethane 2.78
    ethyl orthosilicate 0.09
    tributyl phosphate 0.11
    diacetone alcohol 0.74
    N,N-dimethylaniline 0.07
    acrylonitrile 0.29
    aniline 0.19
    1,3-propanediol 5.64
    bromobenzene 0.01
    dibromomethane 0.06
    1,1,2,2-tetrachloroethane 0.28
    2-methyl-cyclohexyl acetate 0.09
    tetrabutyl urea 0.26
    diisobutyl methanol 0.03
    2-phenylethanol 0.15
    styrene 0.01
    dioctyl adipate 0.19
    dimethyl sulfate 1.8
    ethyl butyrate 0.1
    methyl lactate 2.77
    butyl lactate 0.81
    diethyl carbonate 0.06
    propanediol butyl ether 3.51
    triethyl orthoformate 0.16
    p-tert-butyltoluene 0.01
    methyl 4-tert-butylbenzoate 0.46
    morpholine 5.85
    tert-butylamine 0.06
    n-dodecanol 0.08
    dimethoxymethane 3.26
    ethylene carbonate 0.39
    cyrene 2.74
    2-ethoxyethyl acetate 0.8
    2-ethylhexyl acetate 0.06
    1,2,4-trichlorobenzene 0.04
    4-methylpyridine 0.26
    dibutyl ether 0.1
    2,6-dimethyl-4-heptanol 0.03
    DEF 1.04
    dimethyl isosorbide 1.65
    tetrachloroethylene 0.21
    eugenol 0.67
    triacetin 0.68
    span 80 1.93
    1,4-butanediol 1.56
    1,1-dichloroethane 0.04
    2-methyl-1-pentanol 0.19
    methyl formate 2.74
    2-methyl-1-butanol 0.45
    n-decane 0.01
    butyronitrile 0.09
    3,7-dimethyl-1-octanol 0.1
    1-chlorooctane 0.04
    1-chlorotetradecane 0.01
    n-nonane 0.01
    undecane 0.0
    tert-butylcyclohexane 0.0
    cyclooctane 0.0
    cyclopentanol 0.87
    tetrahydropyran 0.63
    tert-amyl methyl ether 0.15
    2,5,8-trioxanonane 3.11
    1-hexene 0.01
    2-isopropoxyethanol 1.4
    2,2,2-trifluoroethanol 2.08
    methyl butyrate 0.18

    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