5-Hydroxycalamenene

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    95908-33-1

    Molecular formula
    C15H22O

    SMILES
    C[C@@H]1CC[C@H](C2=C1C(=CC(=C2)C)O)C(C)C

    Retention indicies (RI)

    • Carbowax: 2734.0

  • Odor profile

    Spicy 62.41%
    Woody 60.29%
    Phenolic 59.57%
    Leathery 45.09%
    Medicinal 39.66%
    Dry 38.9%
    Smoky 37.34%
    Animal 35.9%
    Herbal 32.78%
    Amber 29.74%

    Scent© AI

  • Properties

    XLogP3-AA
    4.8

    Molecular weight
    218.33 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    321°C

    Flash point est.
    134.98 ˚C

  • Synonyms

    • 5-Hydroxycalamenene
    • DTXSID201017474
    • 95908-33-1
    • DTXCID901475669
    • (5S,8R)-3,8-dimethyl-5-propan-2-yl-5,6,7,8-tetrahydronaphthalen-1-ol

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1355.22
    methanol 965.74
    isopropanol 1265.8
    water 0.09
    ethyl acetate 900.11
    n-propanol 1189.68
    acetone 2042.33
    n-butanol 1074.36
    acetonitrile 1163.1
    DMF 2213.61
    toluene 871.68
    isobutanol 769.99
    1,4-dioxane 3060.11
    methyl acetate 889.19
    THF 5666.53
    2-butanone 1405.3
    n-pentanol 589.82
    sec-butanol 709.92
    n-hexane 142.01
    ethylene glycol 49.53
    NMP 848.7
    cyclohexane 302.02
    DMSO 1016.12
    n-butyl acetate 1136.91
    n-octanol 305.66
    chloroform 2687.04
    n-propyl acetate 522.74
    acetic acid 382.05
    dichloromethane 2774.64
    cyclohexanone 2030.24
    propylene glycol 126.23
    isopropyl acetate 505.57
    DMAc 633.72
    2-ethoxyethanol 455.05
    isopentanol 722.22
    n-heptane 152.3
    ethyl formate 747.6
    1,2-dichloroethane 1650.01
    n-hexanol 1051.87
    2-methoxyethanol 982.22
    isobutyl acetate 371.71
    tetrachloromethane 324.84
    n-pentyl acetate 482.07
    transcutol 866.73
    n-heptanol 334.54
    ethylbenzene 281.41
    MIBK 515.21
    2-propoxyethanol 1109.24
    tert-butanol 949.11
    MTBE 996.19
    2-butoxyethanol 430.99
    propionic acid 355.92
    o-xylene 294.2
    formic acid 54.56
    diethyl ether 1469.88
    m-xylene 465.06
    p-xylene 355.08
    chlorobenzene 796.24
    dimethyl carbonate 217.89
    n-octane 54.06
    formamide 160.25
    cyclopentanone 2437.03
    2-pentanone 1213.89
    anisole 425.36
    cyclopentyl methyl ether 1364.76
    gamma-butyrolactone 1901.11
    1-methoxy-2-propanol 793.04
    pyridine 2016.14
    3-pentanone 630.68
    furfural 915.18
    n-dodecane 39.11
    diethylene glycol 374.93
    diisopropyl ether 286.02
    tert-amyl alcohol 529.49
    acetylacetone 752.25
    n-hexadecane 47.35
    acetophenone 308.42
    methyl propionate 609.1
    isopentyl acetate 799.04
    trichloroethylene 2389.24
    n-nonanol 259.71
    cyclohexanol 795.1
    benzyl alcohol 343.29
    2-ethylhexanol 444.91
    isooctanol 241.31
    dipropyl ether 782.39
    1,2-dichlorobenzene 463.16
    ethyl lactate 142.3
    propylene carbonate 727.55
    n-methylformamide 861.44
    2-pentanol 584.8
    n-pentane 160.04
    1-propoxy-2-propanol 721.15
    1-methoxy-2-propyl acetate 596.39
    2-(2-methoxypropoxy) propanol 255.31
    mesitylene 238.08
    ε-caprolactone 1109.02
    p-cymene 216.54
    epichlorohydrin 2247.09
    1,1,1-trichloroethane 1148.44
    2-aminoethanol 189.85
    morpholine-4-carbaldehyde 1050.26
    sulfolane 1066.46
    2,2,4-trimethylpentane 50.18
    2-methyltetrahydrofuran 2483.19
    n-hexyl acetate 601.72
    isooctane 53.16
    2-(2-butoxyethoxy)ethanol 404.52
    sec-butyl acetate 273.99
    tert-butyl acetate 453.35
    decalin 81.61
    glycerin 111.18
    diglyme 820.92
    acrylic acid 229.87
    isopropyl myristate 196.31
    n-butyric acid 794.94
    acetyl acetate 353.74
    di(2-ethylhexyl) phthalate 171.28
    ethyl propionate 336.52
    nitromethane 934.31
    1,2-diethoxyethane 765.99
    benzonitrile 598.21
    trioctyl phosphate 142.44
    1-bromopropane 1191.3
    gamma-valerolactone 2248.91
    n-decanol 191.1
    triethyl phosphate 133.93
    4-methyl-2-pentanol 256.05
    propionitrile 984.52
    vinylene carbonate 636.81
    1,1,2-trichlorotrifluoroethane 558.23
    DMS 289.99
    cumene 167.35
    2-octanol 229.02
    2-hexanone 628.7
    octyl acetate 264.67
    limonene 346.2
    1,2-dimethoxyethane 1263.28
    ethyl orthosilicate 144.93
    tributyl phosphate 149.59
    diacetone alcohol 425.6
    N,N-dimethylaniline 240.98
    acrylonitrile 901.95
    aniline 601.41
    1,3-propanediol 486.29
    bromobenzene 869.54
    dibromomethane 1840.69
    1,1,2,2-tetrachloroethane 1372.51
    2-methyl-cyclohexyl acetate 325.72
    tetrabutyl urea 198.94
    diisobutyl methanol 219.25
    2-phenylethanol 493.94
    styrene 353.14
    dioctyl adipate 241.99
    dimethyl sulfate 221.92
    ethyl butyrate 471.18
    methyl lactate 155.0
    butyl lactate 258.77
    diethyl carbonate 235.32
    propanediol butyl ether 317.84
    triethyl orthoformate 280.32
    p-tert-butyltoluene 220.45
    methyl 4-tert-butylbenzoate 279.02
    morpholine 3368.2
    tert-butylamine 642.63
    n-dodecanol 146.61
    dimethoxymethane 1444.19
    ethylene carbonate 591.28
    cyrene 268.1
    2-ethoxyethyl acetate 506.77
    2-ethylhexyl acetate 606.9
    1,2,4-trichlorobenzene 464.03
    4-methylpyridine 1692.79
    dibutyl ether 460.87
    2,6-dimethyl-4-heptanol 219.25
    DEF 832.52
    dimethyl isosorbide 534.15
    tetrachloroethylene 846.92
    eugenol 249.97
    triacetin 279.53
    span 80 301.83
    1,4-butanediol 147.86
    1,1-dichloroethane 1604.31
    2-methyl-1-pentanol 418.17
    methyl formate 693.07
    2-methyl-1-butanol 598.64
    n-decane 72.87
    butyronitrile 1287.07
    3,7-dimethyl-1-octanol 261.1
    1-chlorooctane 259.49
    1-chlorotetradecane 97.43
    n-nonane 72.75
    undecane 52.4
    tert-butylcyclohexane 75.4
    cyclooctane 87.59
    cyclopentanol 906.16
    tetrahydropyran 3559.91
    tert-amyl methyl ether 464.17
    2,5,8-trioxanonane 428.88
    1-hexene 495.08
    2-isopropoxyethanol 321.98
    2,2,2-trifluoroethanol 84.98
    methyl butyrate 515.88

    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
Eugenia banderensis leaf (Cuba) Eugenia banderensis Urb., fam. Myrtaceae 0.64%