Propham

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  • Identifiers

    CAS number
    122-42-9

    Molecular formula
    C10H13NO2

    SMILES
    CC(C)OC(=O)NC1=CC=CC=C1

    Safety labels

    Irritant
    Irritant

  • Odor profile

    Fruity 51.67%
    Floral 48.04%
    Grape 45.33%
    Honey 38.67%
    Sweet 32.41%
    Animal 30.32%
    Citrus 23.39%
    Cheesy 22.97%
    Tropical 22.87%
    Rose 22.77%

    Scent© AI

  • Properties

    XLogP3-AA
    2.6

    Molecular weight
    179.22 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    282°C

    Melting point expt.

    • 90 °C

    Flash point est.
    109.91 ˚C

    Solubility expt.

    • Soluble in most organic solvents
    • Soluble in esters, alcohols, acetone, benzene, cyclohexane and xylene.
    • SOL IN CARBON DISULFIDE; SLIGHTLY SOL IN KEROSENE OR DIESEL OIL; VERY SOL IN ETHYL OR ISOPROPYL ALCOHOL
    • In water, 179 mg/L at 25 °C

  • Synonyms

    • Propham
    • 122-42-9
    • Isopropyl phenylcarbamate
    • Isopropyl N-phenylcarbamate
    • Collavin
    • Triherbide
    • Tuberite
    • Agermin
    • Birgin
    • Profam
    • Tuberit
    • Tixit
    • Isopropyl carbanilate
    • Chem-Hoe
    • Ban-Hoe
    • Premalox
    • Prophame
    • Triherbide-Ipc
    • Beet-Kleen
    • Ortho grass killer
    • Isopropyl phenyl urethane
    • INPC
    • IPPC
    • Usaf d-9
    • Isopropyl phenylcarbmate
    • Iso.ppc.
    • N-Phenyl isopropyl carbamate
    • 1-Methylethyl phenylcarbamate
    • o-Isopropyl N-phenylcarbamate
    • Isopropyl carbanilic acid ester
    • Isopropyl-N-phenylurethan
    • propan-2-yl N-phenylcarbamate
    • Carbanilic acid, isopropyl ester
    • Isopropyl-N-phenylcarbamate
    • Isopropyl-N-fenyl-carbamaat
    • Isopropyl-N-phenyl-carbamat
    • Caswell No. 510
    • Isopropil-N-fenil-carbammato
    • Propham [BSI:ISO]
    • Carbamic acid, N-phenyl-, 1-methylethyl ester
    • n-Phenylcarbamate d'isopropyle
    • Prophame [ISO-French]
    • IsoPPC
    • Carbamic acid, phenyl-, 1-methylethyl ester
    • N-Phenylcarbamic acid, isopropyl ester
    • Propham [ISO]
    • Isopropyl-N-phenyl carbamate
    • ISO.PPC
    • HSDB 602
    • O-Isopropyl N-phenyl carbamate
    • Isopropylester kyseliny karbanilove
    • Isopropyl-N-phenylurethan [German]
    • RCRA waste no. U373
    • NSC 2105
    • EINECS 204-542-0
    • Isopropyl-N-fenyl-carbamaat [Dutch]
    • Isopropyl-N-phenyl-carbamat [German]
    • Isopropil-N-fenil-carbammato [Italian]
    • BRN 2209666
    • N-Phenylcarbamate d'isopropyle [French]
    • 1-methylethyl N-phenylcarbamate
    • Phenylcarbamic acid, 1-methylethyl ester
    • DTXSID7020766
    • CHEBI:82035
    • AI3-14879
    • Isopropylester kyseliny karbanilove [Czech]
    • Carbamate pesticide IPC
    • Y647G714RY
    • NSC-2105
    • PROPHAM [HSDB]
    • PROPHAM [IARC]
    • PROPHAM [MI]
    • IFC
    • IFK
    • propan-2-yl phenylcarbamate
    • Phenylcarbamic acid,1-methylethyl ester
    • N-Phenyl-O-isopropylurethane
    • DTXCID70766
    • Y 2
    • Propham 100 microg/mL in Toluene
    • 4-12-00-00620 (Beilstein Handbook Reference)
    • MFCD00026382
    • Propham 10 microg/mL in Acetonitrile
    • Carbamic acid, phenyl, isopropyl ester
    • Propham 100 microg/mL in Acetonitrile
    • Prophame (ISO-French)
    • PROPHAM (IARC)
    • CAS-122-42-9
    • Merck 4925
    • Merck-4925
    • ChemHoe
    • UNII-Y647G714RY
    • BanHoe
    • carbanilic acid isopropyl ester
    • TriherbideIPC
    • Chem Hoe FL4
    • IsopropylNphenylurethan
    • Phenylcarbamic acid 1-methylethyl ester
    • IsopropylNfenylcarbamaat
    • IsopropylNphenylcarbamat
    • IsopropilNfenilcarbammato
    • IsopropylNphenylcarbamate
    • Enamine_005910
    • IPC. IPPC
    • iso-Propyl phenylcarbamate
    • Phenyl isopropyl carbamate
    • NPhenyl isopropyl carbamate
    • 1Methylethyl phenylcarbamate
    • OIsopropyl Nphenyl carbamate
    • MSS IPC 50
    • NPhenylcarbamate d'isopropyle
    • SCHEMBL67344
    • Propham, ~99%, crystalline
    • WLN: 1Y1 & OVMR
    • CHEMBL1080996
    • ISOPROPYL N-PHENYLURETHANE
    • NSC2105
    • HMS1410M14
    • Tox21_201664
    • Tox21_302973
    • NPhenylcarbamic acid, isopropyl ester
    • AKOS001022035
    • Phenylcarbamic acid, 1methylethyl ester
    • IDI1_008145
    • USEPA/OPP Pesticide Code: 047601
    • NCGC00163998-01
    • NCGC00163998-02
    • NCGC00256576-01

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 346.13
    methanol 449.64
    isopropanol 247.83
    water 2.02
    ethyl acetate 117.64
    n-propanol 240.27
    acetone 321.11
    n-butanol 205.47
    acetonitrile 122.88
    DMF 1077.49
    toluene 26.08
    isobutanol 167.42
    1,4-dioxane 356.06
    methyl acetate 128.12
    THF 597.86
    2-butanone 156.4
    n-pentanol 142.71
    sec-butanol 177.56
    n-hexane 9.31
    ethylene glycol 102.33
    NMP 496.6
    cyclohexane 12.65
    DMSO 790.61
    n-butyl acetate 91.05
    n-octanol 62.73
    chloroform 313.75
    n-propyl acetate 71.0
    acetic acid 507.44
    dichloromethane 199.45
    cyclohexanone 250.71
    propylene glycol 187.77
    isopropyl acetate 73.36
    DMAc 636.04
    2-ethoxyethanol 181.85
    isopentanol 144.61
    n-heptane 4.61
    ethyl formate 108.38
    1,2-dichloroethane 137.54
    n-hexanol 129.14
    2-methoxyethanol 435.23
    isobutyl acetate 52.06
    tetrachloromethane 14.67
    n-pentyl acetate 54.87
    transcutol 443.15
    n-heptanol 50.65
    ethylbenzene 20.12
    MIBK 79.46
    2-propoxyethanol 246.34
    tert-butanol 237.59
    MTBE 99.81
    2-butoxyethanol 109.71
    propionic acid 227.5
    o-xylene 22.11
    formic acid 169.81
    diethyl ether 96.15
    m-xylene 22.12
    p-xylene 32.52
    chlorobenzene 73.75
    dimethyl carbonate 81.25
    n-octane 2.58
    formamide 199.3
    cyclopentanone 350.28
    2-pentanone 123.26
    anisole 79.65
    cyclopentyl methyl ether 139.05
    gamma-butyrolactone 415.39
    1-methoxy-2-propanol 302.84
    pyridine 199.71
    3-pentanone 82.54
    furfural 305.83
    n-dodecane 3.97
    diethylene glycol 213.89
    diisopropyl ether 23.57
    tert-amyl alcohol 156.77
    acetylacetone 170.17
    n-hexadecane 4.37
    acetophenone 83.87
    methyl propionate 121.49
    isopentyl acetate 87.02
    trichloroethylene 276.19
    n-nonanol 55.69
    cyclohexanol 144.44
    benzyl alcohol 86.52
    2-ethylhexanol 56.74
    isooctanol 39.08
    dipropyl ether 49.55
    1,2-dichlorobenzene 69.78
    ethyl lactate 70.85
    propylene carbonate 213.88
    n-methylformamide 277.54
    2-pentanol 107.01
    n-pentane 6.79
    1-propoxy-2-propanol 143.69
    1-methoxy-2-propyl acetate 117.43
    2-(2-methoxypropoxy) propanol 134.16
    mesitylene 16.32
    ε-caprolactone 197.34
    p-cymene 18.65
    epichlorohydrin 331.57
    1,1,1-trichloroethane 89.73
    2-aminoethanol 210.42
    morpholine-4-carbaldehyde 394.52
    sulfolane 471.37
    2,2,4-trimethylpentane 5.18
    2-methyltetrahydrofuran 258.6
    n-hexyl acetate 98.41
    isooctane 3.67
    2-(2-butoxyethoxy)ethanol 186.78
    sec-butyl acetate 47.41
    tert-butyl acetate 85.21
    decalin 7.17
    glycerin 226.1
    diglyme 262.78
    acrylic acid 219.78
    isopropyl myristate 40.8
    n-butyric acid 258.7
    acetyl acetate 98.0
    di(2-ethylhexyl) phthalate 56.71
    ethyl propionate 70.34
    nitromethane 461.79
    1,2-diethoxyethane 96.99
    benzonitrile 93.26
    trioctyl phosphate 39.25
    1-bromopropane 67.14
    gamma-valerolactone 411.64
    n-decanol 43.6
    triethyl phosphate 46.28
    4-methyl-2-pentanol 56.83
    propionitrile 101.44
    vinylene carbonate 188.22
    1,1,2-trichlorotrifluoroethane 279.0
    DMS 94.99
    cumene 18.3
    2-octanol 35.13
    2-hexanone 87.12
    octyl acetate 57.44
    limonene 27.75
    1,2-dimethoxyethane 287.19
    ethyl orthosilicate 42.22
    tributyl phosphate 50.29
    diacetone alcohol 150.83
    N,N-dimethylaniline 61.49
    acrylonitrile 131.02
    aniline 84.88
    1,3-propanediol 256.4
    bromobenzene 59.35
    dibromomethane 125.14
    1,1,2,2-tetrachloroethane 261.56
    2-methyl-cyclohexyl acetate 67.62
    tetrabutyl urea 67.83
    diisobutyl methanol 31.63
    2-phenylethanol 84.5
    styrene 28.35
    dioctyl adipate 69.6
    dimethyl sulfate 145.66
    ethyl butyrate 63.78
    methyl lactate 119.98
    butyl lactate 71.92
    diethyl carbonate 56.34
    propanediol butyl ether 143.17
    triethyl orthoformate 56.01
    p-tert-butyltoluene 18.93
    methyl 4-tert-butylbenzoate 88.3
    morpholine 432.26
    tert-butylamine 108.88
    n-dodecanol 34.18
    dimethoxymethane 293.26
    ethylene carbonate 154.4
    cyrene 127.54
    2-ethoxyethyl acetate 78.39
    2-ethylhexyl acetate 62.91
    1,2,4-trichlorobenzene 93.64
    4-methylpyridine 163.95
    dibutyl ether 50.98
    2,6-dimethyl-4-heptanol 31.63
    DEF 178.0
    dimethyl isosorbide 192.16
    tetrachloroethylene 124.61
    eugenol 103.73
    triacetin 101.1
    span 80 125.36
    1,4-butanediol 99.49
    1,1-dichloroethane 118.67
    2-methyl-1-pentanol 105.39
    methyl formate 187.79
    2-methyl-1-butanol 133.65
    n-decane 5.51
    butyronitrile 116.18
    3,7-dimethyl-1-octanol 56.4
    1-chlorooctane 26.44
    1-chlorotetradecane 13.17
    n-nonane 4.84
    undecane 4.57
    tert-butylcyclohexane 7.18
    cyclooctane 2.96
    cyclopentanol 204.66
    tetrahydropyran 265.42
    tert-amyl methyl ether 71.75
    2,5,8-trioxanonane 218.03
    1-hexene 40.65
    2-isopropoxyethanol 111.33
    2,2,2-trifluoroethanol 131.82
    methyl butyrate 101.81

    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