Dimethyl benzyl carbinyl acetate

Overview IFRA Request a quote

  • Identifiers

    CAS number
    151-05-3

    Molecular formula
    C12H16O2

    SMILES
    CC(=O)OC(C)(C)CC1=CC=CC=C1

  • Odor profile

    Floral 86.97%
    Fruity 85.55%
    Green 78.1%
    Sweet 71.58%
    Fresh 65.19%
    Rose 50.03%
    Herbal 49.18%
    Jasmin 45.3%
    Balsamic 40.15%
    Spicy 38.17%

    Scent© AI

  • Properties

    XLogP3-AA
    2.7

    Molecular weight
    192.25 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderately slow

    Boiling point est.
    233°C

    Melting point expt.

    • 30 °C

    Flash point est.
    111.02 ˚C

    Solubility expt.

    • Soluble in mineral oil, most fixed oils and propylene glycol; insoluble in water
    • Soluble (in ethanol)

  • Synonyms

    • Dimethylbenzylcarbinyl acetate
    • 151-05-3
    • Dimethyl benzyl carbinyl acetate
    • 2-methyl-1-phenylpropan-2-yl acetate
    • Dmbca
    • 1,1-Dimethyl-2-phenylethyl acetate
    • Benzyldimethylcarbinyl acetate
    • alpha,alpha-Dimethylphenethyl acetate
    • Benzyldimethylcarbinol acetate
    • Dimethylbenzylcarbinol acetate
    • Benzyl dimethyl carbinyl acetate
    • Benzeneethanol, alpha,alpha-dimethyl-, 1-acetate
    • 2-Benzyl-2-propyl acetate
    • Dimethylbenzyl carbinol acetate
    • FEMA No. 2392
    • Benzyldimethyl carbinyl acetate
    • alpha,alpha-Dimethylbenzeneethyl acetate
    • (2-methyl-1-phenylpropan-2-yl) acetate
    • EINECS 205-781-3
    • alpha,alpha-Dimethylphenethyl alcohol, acetate
    • NSC 46123
    • Benzeneethanol, alpha,alpha-dimethyl-, acetate
    • BRN 1941670
    • DTXSID3041877
    • Benzeneethanol, .alpha.,.alpha.-dimethyl-, acetate
    • .alpha.,.alpha.-Dimethylphenethyl acetate
    • AI3-24339
    • PHENETHYL ALCOHOL, alpha,alpha-DIMETHYL-, ACETATE
    • 6Y9488RL8H
    • Acetic Acid 1,1-Dimethyl-2-phenylethyl Ester
    • NSC-46123
    • 2-Methyl-1-phenyl-2-propanyl acetate
    • Phenethyl alcohol, .alpha.,.alpha.-dimethyl-, acetate
    • DTXCID1021877
    • 2-Methyl-1-phenyl-2-propyl acetate
    • Benzeneethanol, .alpha.,.alpha.-dimethyl-, 1-acetate
    • DIMETHYL BENZYL CARBINYL ACETATE [FCC]
    • ALPHA.,.ALPHA.-DIMETHYLPHENETHYL ACETATE [FHFI]
    • UNII-6Y9488RL8H
    • .alpha., acetate
    • MFCD00026196
    • Acetic Acid alpha,alpha-Dimethylphenethyl Ester
    • dimethylbenzyl carbinyl acetate
    • SCHEMBL111212
    • dimethyl benzyl carbinol acetate
    • CHEMBL3561182
    • FEMA 2392
    • FLUWAIIVLCVEKF-UHFFFAOYSA-
    • CHEBI:179909
    • NSC46123
    • Tox21_301781
    • STL563732
    • AKOS015913743
    • 1,1-Dimethyl-2-phenylethyl acetate #
    • CS-W015807
    • FD05896
    • WLN: 1VOX1 & 1 & 1R
    • NCGC00255449-01
    • Benzeneethanol,.alpha.-dimethyl-, acetate
    • CAS-151-05-3
    • (2-methyl-1-phenyl-propan-2-yl) acetate
    • A0674
    • ALPHA.,ALPHA-DIMETHYLPHENETHYL ACETATE
    • NS00009196
    • Phenethyl alcohol,.alpha.-dimethyl-, acetate
    • alpha, alpha-Dimethylphenethyl alcohol, acetate
    • D88304
    • .alpha.,.alpha.-Dimethylphenethyl alcohol, acetate
    • Q27265714
    • alpha,alpha-Dimethylphenethyl acetate, >=98%, FCC, FG
    • alpha,alpha-Dimethylphenethyl acetate, analytical standard
    • Acetic acid .alpha.,.alpha.-dimethyl-.beta.-phenylethyl ester
    • 205-781-3
    • InChI=1/C12H16O2/c1-10(13)14-12(2,3)9-11-7-5-4-6-8-11/h4-8H,9H2,1-3H3

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1146.65
    methanol 1736.87
    isopropanol 824.72
    water 11.82
    ethyl acetate 710.44
    n-propanol 892.4
    acetone 989.32
    n-butanol 794.55
    acetonitrile 709.26
    DMF 1429.95
    toluene 362.66
    isobutanol 668.08
    1,4-dioxane 1168.06
    methyl acetate 771.3
    THF 1450.51
    2-butanone 711.44
    n-pentanol 529.62
    sec-butanol 683.32
    n-hexane 219.5
    ethylene glycol 337.6
    NMP 1222.43
    cyclohexane 213.51
    DMSO 775.37
    n-butyl acetate 372.82
    n-octanol 279.97
    chloroform 1661.43
    n-propyl acetate 310.19
    acetic acid 1023.28
    dichloromethane 1255.2
    cyclohexanone 1005.02
    propylene glycol 454.21
    isopropyl acetate 406.16
    DMAc 1426.3
    2-ethoxyethanol 600.39
    isopentanol 617.83
    n-heptane 88.57
    ethyl formate 488.31
    1,2-dichloroethane 786.5
    n-hexanol 745.27
    2-methoxyethanol 1074.14
    isobutyl acetate 237.89
    tetrachloromethane 194.65
    n-pentyl acetate 235.83
    transcutol 1439.0
    n-heptanol 208.06
    ethylbenzene 206.5
    MIBK 380.12
    2-propoxyethanol 955.93
    tert-butanol 867.47
    MTBE 692.98
    2-butoxyethanol 329.94
    propionic acid 773.32
    o-xylene 244.96
    formic acid 503.34
    diethyl ether 886.41
    m-xylene 279.64
    p-xylene 237.22
    chlorobenzene 419.38
    dimethyl carbonate 326.63
    n-octane 31.67
    formamide 391.72
    cyclopentanone 921.79
    2-pentanone 624.97
    anisole 390.45
    cyclopentyl methyl ether 875.58
    gamma-butyrolactone 993.52
    1-methoxy-2-propanol 802.0
    pyridine 647.18
    3-pentanone 531.32
    furfural 787.05
    n-dodecane 26.94
    diethylene glycol 674.78
    diisopropyl ether 235.81
    tert-amyl alcohol 654.28
    acetylacetone 597.4
    n-hexadecane 30.19
    acetophenone 317.57
    methyl propionate 634.68
    isopentyl acetate 314.26
    trichloroethylene 1215.23
    n-nonanol 231.06
    cyclohexanol 730.63
    benzyl alcohol 342.55
    2-ethylhexanol 311.6
    isooctanol 158.68
    dipropyl ether 358.57
    1,2-dichlorobenzene 338.32
    ethyl lactate 202.48
    propylene carbonate 568.91
    n-methylformamide 700.06
    2-pentanol 500.24
    n-pentane 160.62
    1-propoxy-2-propanol 509.83
    1-methoxy-2-propyl acetate 441.3
    2-(2-methoxypropoxy) propanol 359.68
    mesitylene 169.45
    ε-caprolactone 832.14
    p-cymene 110.39
    epichlorohydrin 1028.21
    1,1,1-trichloroethane 708.28
    2-aminoethanol 575.63
    morpholine-4-carbaldehyde 1153.41
    sulfolane 947.17
    2,2,4-trimethylpentane 62.44
    2-methyltetrahydrofuran 1060.93
    n-hexyl acetate 451.07
    isooctane 43.36
    2-(2-butoxyethoxy)ethanol 491.17
    sec-butyl acetate 230.6
    tert-butyl acetate 413.8
    decalin 93.95
    glycerin 523.55
    diglyme 752.5
    acrylic acid 612.71
    isopropyl myristate 145.58
    n-butyric acid 817.56
    acetyl acetate 436.64
    di(2-ethylhexyl) phthalate 168.09
    ethyl propionate 333.56
    nitromethane 1117.56
    1,2-diethoxyethane 397.36
    benzonitrile 371.36
    trioctyl phosphate 115.73
    1-bromopropane 604.97
    gamma-valerolactone 1154.17
    n-decanol 164.42
    triethyl phosphate 144.7
    4-methyl-2-pentanol 251.85
    propionitrile 538.11
    vinylene carbonate 546.38
    1,1,2-trichlorotrifluoroethane 742.62
    DMS 401.74
    cumene 150.94
    2-octanol 151.02
    2-hexanone 381.76
    octyl acetate 202.81
    limonene 186.71
    1,2-dimethoxyethane 863.83
    ethyl orthosilicate 144.53
    tributyl phosphate 153.97
    diacetone alcohol 469.63
    N,N-dimethylaniline 266.18
    acrylonitrile 544.48
    aniline 461.52
    1,3-propanediol 602.53
    bromobenzene 394.9
    dibromomethane 860.43
    1,1,2,2-tetrachloroethane 1069.62
    2-methyl-cyclohexyl acetate 245.19
    tetrabutyl urea 207.98
    diisobutyl methanol 130.12
    2-phenylethanol 363.33
    styrene 238.67
    dioctyl adipate 212.22
    dimethyl sulfate 459.03
    ethyl butyrate 255.09
    methyl lactate 343.2
    butyl lactate 214.63
    diethyl carbonate 191.21
    propanediol butyl ether 403.31
    triethyl orthoformate 191.28
    p-tert-butyltoluene 108.29
    methyl 4-tert-butylbenzoate 294.52
    morpholine 1336.9
    tert-butylamine 551.65
    n-dodecanol 120.27
    dimethoxymethane 896.02
    ethylene carbonate 491.04
    cyrene 341.81
    2-ethoxyethyl acetate 339.44
    2-ethylhexyl acetate 262.48
    1,2,4-trichlorobenzene 412.78
    4-methylpyridine 747.63
    dibutyl ether 286.27
    2,6-dimethyl-4-heptanol 130.12
    DEF 737.89
    dimethyl isosorbide 532.74
    tetrachloroethylene 681.35
    eugenol 281.05
    triacetin 386.08
    span 80 339.05
    1,4-butanediol 292.91
    1,1-dichloroethane 835.76
    2-methyl-1-pentanol 419.42
    methyl formate 599.01
    2-methyl-1-butanol 620.84
    n-decane 48.36
    butyronitrile 577.37
    3,7-dimethyl-1-octanol 236.95
    1-chlorooctane 183.9
    1-chlorotetradecane 67.06
    n-nonane 52.24
    undecane 34.46
    tert-butylcyclohexane 89.98
    cyclooctane 69.77
    cyclopentanol 676.87
    tetrahydropyran 1217.91
    tert-amyl methyl ether 531.86
    2,5,8-trioxanonane 541.83
    1-hexene 466.58
    2-isopropoxyethanol 395.17
    2,2,2-trifluoroethanol 346.52
    methyl butyrate 425.97

    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