Chlorphenesin Carbamate

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  • Identifiers

    CAS number
    886-74-8

    Molecular formula
    C10H12ClNO4

    SMILES
    C1=CC(=CC=C1OCC(COC(=O)N)O)Cl

  • Odor profile

    Fragrance
    Odorless 50.7%
    Sweet 27.59%
    Savory 26.57%
    Grape 26.02%
    Fruity 25.12%
    Milky 23.72%
    Fatty 20.75%
    Meaty 20.74%
    Cooked 19.93%
    Animal 19.73%

     

    Flavor
    Odorless 54.23%
    Fruity 37.83%
    Mild 36.94%
    Sweet 32.45%
    Bitter 30.26%
    Very mild 27.28%
    Bland 25.67%
    Grape 23.45%
    Sweet-like 22.98%
    Faint 21.49%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    1.2

    pKa est.
    7.81 (neutral)

    Molecular weight
    245.66 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    407°C

    Melting point expt.

    • 89-91 °C

    Flash point

    • 205.93 ˚C est.

    Solubility expt.

    • READILY SOL IN 95% ETHANOL, ACETONE, ETHYL ACETATE; FAIRLY READILY SOL IN DIOXANE; ALMOST INSOL IN COLD WATER, BENZENE, CYCLOHEXANE
    • SLIGHTLY SOL IN CHLOROFORM
    • FREELY SOL IN ALCOHOL

  • Synonyms

    • CHLORPHENESIN CARBAMATE
    • 886-74-8
    • Maolate
    • Rinlaxer
    • 3-(4-Chlorophenoxy)-2-hydroxypropyl carbamate
    • Kolpicortin-sine
    • 3-(p-Chlorophenoxy)-1,2-propanediol 1-carbamate
    • 3-(p-Chlorophenoxy)-2-hydroxypropyl carbamate
    • Chlorphensin carbamate
    • 3-(4-Chlorophenoxy)-1,2-propanediol-1-carbamate
    • U-19,646
    • 1,2-Propanediol, 3-(4-chlorophenoxy)-, 1-carbamate
    • CHLORPHENESINCARBAMATE
    • NSC 82943
    • Carbamic acid, 3-(p-chlorophenoxy)-2-hydroxypropyl ester
    • HSDB 3031
    • 3-(p-Chlorophenoxy)-1,2-propanediol-1-carbamate
    • U 19646
    • 1,2-Propanediol,3-(4-chlorophenoxy)-, 1-carbamate
    • 1,2-Propanediol, 3-(p-chlorophenoxy)-, 1-carbamate
    • EINECS 212-954-7
    • UNII-57U5YI11WP
    • NSC-82943
    • [3-(4-chlorophenoxy)-2-hydroxypropyl] carbamate
    • BRN 1978575
    • 57U5YI11WP
    • CHEBI:3643
    • DTXSID5022803
    • carbamic acid 3-(p-chlorophenoxy)-2-hydroxypropyl ester
    • NSC82943
    • HQC4WI89YG
    • 1,2-propanediol-3-(p-chlorophenoxy)-1-carbamate
    • DTXCID002803
    • Chlorphenesin carbamate, (-)-
    • U-19646
    • (3-p-Chlorophenoxy)-2-hydroxypropylcarbamate
    • 1,2-Propanediol, 3-(4-chlorophenoxy)-, 1-carbamate, (-)-
    • Maolate; NSC 82943; Rhnesicn; Rinlaxer; U 19646; U-19,646
    • CHLORPHENESIN CARBAMATE (MART.)
    • CHLORPHENESIN CARBAMATE [MART.]
    • 126632-50-6
    • Chlorphenesin carbamate [USAN:JAN]
    • NCGC00016548-01
    • CAS-886-74-8
    • Prestwick_882
    • Maolate (TN)
    • Prestwick0_000234
    • Prestwick1_000234
    • Prestwick2_000234
    • Prestwick3_000234
    • UNII-HQC4WI89YG
    • WLN: ZVO1YQ1OR DG
    • SCHEMBL34492
    • BSPBio_000307
    • MLS002154243
    • SPBio_002228
    • BPBio1_000339
    • CHEMBL607710
    • G014XC07GH
    • GLXC-26272
    • HMS1568P09
    • HMS2095P09
    • HMS2232O23
    • HMS3371A08
    • HMS3712P09
    • Maolate Tablets, Maolate Veterinary
    • CHLORPHENESIN CARBAMATE [MI]
    • Tox21_110487
    • CHLORPHENESIN CARBAMATE [JAN]
    • CHLORPHENESIN CARBAMATE [HSDB]
    • CHLORPHENESIN CARBAMATE [USAN]
    • AKOS040744828
    • Chlorphenesin carbamate (JP18/USAN)
    • CCG-220234
    • CHLORPHENESIN CARBAMATE [VANDF]
    • CHLORPHENESIN CARBAMATE, (+)-
    • DB14656
    • CHLORPHENESIN CARBAMATE [WHO-DD]
    • 1, 3-(p-chlorophenoxy)-, 1-carbamate
    • NCGC00179607-01
    • NCGC00179607-03
    • 1, 3-(4-chlorophenoxy)-, 1-carbamate
    • FC177233
    • SMR001233511
    • CHLORPHENESIN CARBAMATE [GREEN BOOK]
    • DB-057097
    • HY-107944
    • CHLORPHENESIN CARBAMATE [ORANGE BOOK]
    • CS-0030953
    • NS00039287
    • C07930
    • D00770
    • [3-(4-chlorophenoxy)-2-hydroxy-propyl] carbamate
    • EN300-23982086
    • SR-01000841824
    • 3-[(4-chlorophenyl)oxy]-2-hydroxypropyl carbamate
    • SR-01000841824-2
    • (2RS)-3-(4-Chlorophenoxy)-2-hydroxypropyl carbamate
    • BRD-A39230911-001-03-7
    • BRD-A39230911-001-10-2
    • Q27106156
    • 1,2-PROPANEDIOL, 3-(4-CHLOROPHENOXY)-, 1-CARBAMATE, (+)-
    • 212-954-7
    • 3-(p-Chlorophenoxy)-1-carbamate; 3-(4-Chlorophenoxy)-2-hydroxypropylcarbamate; 3-(p-Chlorophenoxy)-1,2-propanediol-1-carbamate

  • Applications

    Chlorphenesin Carbamate, CAS 886-74-8, is commonly used in cosmetics and personal care as a preservative and antimicrobial agent; it may also function as an intermediate in the synthesis of other carbamate derivatives for chemical manufacturing. It is sometimes evaluated for use in household cleaning products as a preservative or antimicrobial additive. In coatings, inks and adhesives, it may be considered as a biocidal or preservative component in formulations, subject to formulation limits and local regulations.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 13.95
    methanol 27.83
    isopropanol 9.87
    water 3.62
    ethyl acetate 8.8
    n-propanol 8.47
    acetone 48.89
    n-butanol 6.33
    acetonitrile 12.54
    DMF 196.59
    toluene 0.55
    isobutanol 4.91
    1,4-dioxane 23.82
    methyl acetate 15.84
    THF 67.97
    2-butanone 18.41
    n-pentanol 6.71
    sec-butanol 8.11
    n-hexane 0.17
    ethylene glycol 22.42
    NMP 73.28
    cyclohexane 0.2
    DMSO 312.4
    n-butyl acetate 5.57
    n-octanol 4.69
    chloroform 2.18
    n-propyl acetate 8.13
    acetic acid 46.86
    dichloromethane 2.81
    cyclohexanone 16.39
    propylene glycol 21.59
    isopropyl acetate 6.82
    DMAc 358.5
    2-ethoxyethanol 66.56
    isopentanol 6.1
    n-heptane 0.46
    ethyl formate 12.47
    1,2-dichloroethane 2.84
    n-hexanol 4.04
    2-methoxyethanol 89.83
    isobutyl acetate 4.8
    tetrachloromethane 0.31
    n-pentyl acetate 4.35
    transcutol 86.09
    n-heptanol 4.37
    ethylbenzene 0.76
    MIBK 7.8
    2-propoxyethanol 32.79
    tert-butanol 16.15
    MTBE 7.85
    2-butoxyethanol 19.37
    propionic acid 11.85
    o-xylene 1.16
    formic acid 73.51
    diethyl ether 4.1
    m-xylene 0.77
    p-xylene 1.42
    chlorobenzene 0.89
    dimethyl carbonate 14.45
    n-octane 0.3
    formamide 99.96
    cyclopentanone 30.92
    2-pentanone 10.41
    anisole 8.05
    cyclopentyl methyl ether 7.35
    gamma-butyrolactone 33.08
    1-methoxy-2-propanol 51.38
    pyridine 8.16
    3-pentanone 7.91
    furfural 38.2
    n-dodecane 0.29
    diethylene glycol 51.16
    diisopropyl ether 1.48
    tert-amyl alcohol 12.86
    acetylacetone 25.62
    n-hexadecane 0.33
    acetophenone 12.29
    methyl propionate 12.34
    isopentyl acetate 6.25
    trichloroethylene 5.02
    n-nonanol 4.99
    cyclohexanol 4.92
    benzyl alcohol 9.5
    2-ethylhexanol 3.23
    isooctanol 3.85
    dipropyl ether 5.72
    1,2-dichlorobenzene 1.55
    ethyl lactate 15.47
    propylene carbonate 15.72
    n-methylformamide 50.84
    2-pentanol 3.75
    n-pentane 0.09
    1-propoxy-2-propanol 20.74
    1-methoxy-2-propyl acetate 16.21
    2-(2-methoxypropoxy) propanol 34.32
    mesitylene 0.79
    ε-caprolactone 17.04
    p-cymene 1.44
    epichlorohydrin 26.36
    1,1,1-trichloroethane 1.39
    2-aminoethanol 25.98
    morpholine-4-carbaldehyde 94.71
    sulfolane 59.54
    2,2,4-trimethylpentane 0.17
    2-methyltetrahydrofuran 13.97
    n-hexyl acetate 6.74
    isooctane 0.1
    2-(2-butoxyethoxy)ethanol 34.82
    sec-butyl acetate 5.18
    tert-butyl acetate 9.47
    decalin 0.25
    glycerin 54.24
    diglyme 68.76
    acrylic acid 15.74
    isopropyl myristate 3.98
    n-butyric acid 12.06
    acetyl acetate 9.46
    di(2-ethylhexyl) phthalate 6.83
    ethyl propionate 7.84
    nitromethane 94.56
    1,2-diethoxyethane 15.62
    benzonitrile 5.54
    trioctyl phosphate 4.45
    1-bromopropane 1.04
    gamma-valerolactone 57.04
    n-decanol 4.03
    triethyl phosphate 8.18
    4-methyl-2-pentanol 2.94
    propionitrile 5.95
    vinylene carbonate 13.99
    1,1,2-trichlorotrifluoroethane 43.8
    DMS 10.08
    cumene 0.91
    2-octanol 2.91
    2-hexanone 9.61
    octyl acetate 5.63
    limonene 1.98
    1,2-dimethoxyethane 90.39
    ethyl orthosilicate 7.27
    tributyl phosphate 5.58
    diacetone alcohol 23.98
    N,N-dimethylaniline 9.24
    acrylonitrile 10.31
    aniline 3.0
    1,3-propanediol 27.57
    bromobenzene 0.65
    dibromomethane 1.24
    1,1,2,2-tetrachloroethane 5.51
    2-methyl-cyclohexyl acetate 8.35
    tetrabutyl urea 11.11
    diisobutyl methanol 2.76
    2-phenylethanol 6.95
    styrene 0.86
    dioctyl adipate 9.39
    dimethyl sulfate 40.06
    ethyl butyrate 8.06
    methyl lactate 27.34
    butyl lactate 9.53
    diethyl carbonate 7.61
    propanediol butyl ether 22.64
    triethyl orthoformate 9.37
    p-tert-butyltoluene 1.48
    methyl 4-tert-butylbenzoate 16.21
    morpholine 36.78
    tert-butylamine 4.13
    n-dodecanol 3.24
    dimethoxymethane 64.92
    ethylene carbonate 11.09
    cyrene 36.76
    2-ethoxyethyl acetate 10.15
    2-ethylhexyl acetate 4.3
    1,2,4-trichlorobenzene 2.5
    4-methylpyridine 6.44
    dibutyl ether 4.83
    2,6-dimethyl-4-heptanol 2.76
    DEF 31.62
    dimethyl isosorbide 41.19
    tetrachloroethylene 2.97
    eugenol 18.74
    triacetin 17.32
    span 80 18.51
    1,4-butanediol 18.61
    1,1-dichloroethane 1.34
    2-methyl-1-pentanol 6.1
    methyl formate 37.57
    2-methyl-1-butanol 5.74
    n-decane 0.46
    butyronitrile 5.58
    3,7-dimethyl-1-octanol 4.7
    1-chlorooctane 1.39
    1-chlorotetradecane 0.76
    n-nonane 0.41
    undecane 0.36
    tert-butylcyclohexane 0.21
    cyclooctane 0.13
    cyclopentanol 7.9
    tetrahydropyran 7.13
    tert-amyl methyl ether 7.33
    2,5,8-trioxanonane 59.18
    1-hexene 0.7
    2-isopropoxyethanol 33.91
    2,2,2-trifluoroethanol 22.2
    methyl butyrate 12.29

    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