Diethofencarb

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  • Identifiers

    CAS number
    87130-20-9

    Molecular formula
    C14H21NO4

    SMILES
    CCOC1=C(C=C(C=C1)NC(=O)OC(C)C)OCC

    Safety labels

    Irritant
    Irritant

  • Odor profile

    Fragrance
    Fruity 49.95%
    Odorless 30.68%
    Grape 28.53%
    Floral 26.64%
    Sweet 24.96%
    Vanilla 23.0%
    Berry 22.58%
    Creamy 20.2%
    Savory 19.63%
    Animal 19.54%

     

    Flavor
    Fruity 52.19%
    Bitter 48.38%
    Mild 28.05%
    Grape 25.07%
    Sweet 24.3%
    Odorless 23.23%
    Floral 22.22%
    Bland 21.62%
    Parsley 20.78%
    Orange blossom 20.74%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    2.8

    pKa est.
    7.36 (neutral)

    Molecular weight
    267.32 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    376°C

    Flash point

    • 144.43 ˚C est.

  • Synonyms

    • Diethofencarb
    • 87130-20-9
    • Isopropyl 3,4-diethoxycarbanilate
    • Powmyl WP
    • propan-2-yl N-(3,4-diethoxyphenyl)carbamate
    • Isopropyl N-(3,4-diethoxyphenyl)carbamate
    • DTXSID5037527
    • 1-Methylethyl (3,4-diethoxyphenyl)carbamate
    • Isopropyl 3,4-diethoxyphenylcarbamate
    • Carbamic acid, (3,4-diethoxyphenyl)-, 1-methylethyl ester
    • 421BLT77U4
    • CHEBI:4520
    • DTXCID3017527
    • 1-methylethyl N-(3,4-diethoxyphenyl)carbamate
    • isopropyl-3,4-diethoxycarbanilate
    • RefChem:586957
    • powmil
    • Diethofenacarb
    • Diethofencarb [ISO]
    • Isopropyl (3,4-diethoxyphenyl)carbamate
    • Diethofencarb 10 microg/mL in Cyclohexane
    • Diethofencarb 10 microg/mL in Acetonitrile
    • propan-2-yl (3,4-diethoxyphenyl)carbamate
    • Powmyl
    • S-165
    • S-1605
    • UNII-421BLT77U4
    • S 32165
    • DIETHENOFENCARB
    • DIETHOFENCARB [MI]
    • SCHEMBL22967
    • orb1689575
    • CHEMBL1880404
    • LNJNFVJKDJYTEU-UHFFFAOYSA-
    • MSK20283
    • Tox21_301915
    • MFCD00274591
    • AKOS015889914
    • NCGC00163730-01
    • NCGC00255515-01
    • CAS-87130-20-9
    • DB-056972
    • HY-136384
    • Pesticide3_Diethofencarb_C14H21NO4_Powmil
    • CS-0128943
    • NS00010585
    • Diethofencarb, PESTANAL(R), analytical standard
    • 130D209
    • Q2372095
    • Carbamic acid, N-(3,4-diethoxyphenyl)-, 1-methylethyl ester
    • InChI=1/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)
    • 87130-20-9

  • Applications

    Diethofencarb (CAS 87130-20-9) is a carbamate insecticide primarily used in agriculture for crop protection against a range of chewing and piercing pests. It is also viewed as an intermediate for the synthesis of other carbamate derivatives in agrochemical development; in industrial manufacturing, it can serve as a building block or precursor for specialty chemicals and formulation components. In research and environmental and regulatory assessments, it is evaluated to understand environmental fate and potential impacts, and its use is subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 129.02
    methanol 175.5
    isopropanol 100.84
    water 0.57
    ethyl acetate 209.98
    n-propanol 104.79
    acetone 418.96
    n-butanol 106.03
    acetonitrile 190.73
    DMF 562.83
    toluene 83.6
    isobutanol 87.74
    1,4-dioxane 259.86
    methyl acetate 208.09
    THF 516.3
    2-butanone 199.15
    n-pentanol 93.37
    sec-butanol 102.97
    n-hexane 16.51
    ethylene glycol 47.06
    NMP 575.73
    cyclohexane 30.96
    DMSO 710.06
    n-butyl acetate 142.47
    n-octanol 51.29
    chloroform 823.92
    n-propyl acetate 129.37
    acetic acid 523.76
    dichloromethane 809.58
    cyclohexanone 379.46
    propylene glycol 70.13
    isopropyl acetate 137.41
    DMAc 646.58
    2-ethoxyethanol 154.27
    isopentanol 89.24
    n-heptane 6.72
    ethyl formate 141.75
    1,2-dichloroethane 468.8
    n-hexanol 79.46
    2-methoxyethanol 241.85
    isobutyl acetate 94.15
    tetrachloromethane 80.81
    n-pentyl acetate 102.02
    transcutol 318.51
    n-heptanol 40.06
    ethylbenzene 52.55
    MIBK 107.61
    2-propoxyethanol 166.13
    tert-butanol 147.95
    MTBE 115.08
    2-butoxyethanol 88.34
    propionic acid 207.85
    o-xylene 63.27
    formic acid 151.92
    diethyl ether 125.72
    m-xylene 58.68
    p-xylene 83.53
    chlorobenzene 197.63
    dimethyl carbonate 127.65
    n-octane 5.0
    formamide 186.52
    cyclopentanone 456.61
    2-pentanone 172.51
    anisole 109.36
    cyclopentyl methyl ether 191.95
    gamma-butyrolactone 537.84
    1-methoxy-2-propanol 174.84
    pyridine 261.55
    3-pentanone 158.86
    furfural 401.51
    n-dodecane 6.04
    diethylene glycol 138.52
    diisopropyl ether 38.84
    tert-amyl alcohol 130.13
    acetylacetone 285.56
    n-hexadecane 7.03
    acetophenone 139.16
    methyl propionate 184.13
    isopentyl acetate 136.33
    trichloroethylene 810.96
    n-nonanol 48.17
    cyclohexanol 158.74
    benzyl alcohol 112.93
    2-ethylhexanol 58.73
    isooctanol 37.65
    dipropyl ether 63.92
    1,2-dichlorobenzene 185.82
    ethyl lactate 90.47
    propylene carbonate 315.07
    n-methylformamide 192.34
    2-pentanol 66.88
    n-pentane 11.35
    1-propoxy-2-propanol 117.8
    1-methoxy-2-propyl acetate 159.43
    2-(2-methoxypropoxy) propanol 127.51
    mesitylene 37.53
    ε-caprolactone 309.5
    p-cymene 37.86
    epichlorohydrin 487.72
    1,1,1-trichloroethane 395.09
    2-aminoethanol 81.01
    morpholine-4-carbaldehyde 373.35
    sulfolane 708.67
    2,2,4-trimethylpentane 10.77
    2-methyltetrahydrofuran 278.03
    n-hexyl acetate 140.14
    isooctane 5.53
    2-(2-butoxyethoxy)ethanol 136.16
    sec-butyl acetate 90.63
    tert-butyl acetate 145.3
    decalin 18.63
    glycerin 117.43
    diglyme 239.26
    acrylic acid 219.81
    isopropyl myristate 60.41
    n-butyric acid 241.43
    acetyl acetate 228.85
    di(2-ethylhexyl) phthalate 74.39
    ethyl propionate 127.71
    nitromethane 650.67
    1,2-diethoxyethane 115.29
    benzonitrile 145.4
    trioctyl phosphate 53.17
    1-bromopropane 195.31
    gamma-valerolactone 450.49
    n-decanol 37.06
    triethyl phosphate 90.14
    4-methyl-2-pentanol 44.1
    propionitrile 125.81
    vinylene carbonate 288.05
    1,1,2-trichlorotrifluoroethane 416.5
    DMS 159.47
    cumene 40.17
    2-octanol 34.26
    2-hexanone 126.27
    octyl acetate 80.77
    limonene 54.84
    1,2-dimethoxyethane 255.58
    ethyl orthosilicate 79.02
    tributyl phosphate 74.68
    diacetone alcohol 148.92
    N,N-dimethylaniline 90.5
    acrylonitrile 171.66
    aniline 122.98
    1,3-propanediol 121.51
    bromobenzene 215.44
    dibromomethane 498.59
    1,1,2,2-tetrachloroethane 657.05
    2-methyl-cyclohexyl acetate 112.18
    tetrabutyl urea 91.96
    diisobutyl methanol 36.38
    2-phenylethanol 99.37
    styrene 69.39
    dioctyl adipate 101.3
    dimethyl sulfate 263.28
    ethyl butyrate 116.05
    methyl lactate 124.59
    butyl lactate 89.54
    diethyl carbonate 104.18
    propanediol butyl ether 97.79
    triethyl orthoformate 93.43
    p-tert-butyltoluene 36.96
    methyl 4-tert-butylbenzoate 125.35
    morpholine 286.97
    tert-butylamine 82.91
    n-dodecanol 30.71
    dimethoxymethane 253.03
    ethylene carbonate 239.92
    cyrene 159.02
    2-ethoxyethyl acetate 132.9
    2-ethylhexyl acetate 109.59
    1,2,4-trichlorobenzene 221.8
    4-methylpyridine 245.61
    dibutyl ether 67.78
    2,6-dimethyl-4-heptanol 36.38
    DEF 239.0
    dimethyl isosorbide 210.07
    tetrachloroethylene 384.32
    eugenol 113.0
    triacetin 164.16
    span 80 111.76
    1,4-butanediol 64.61
    1,1-dichloroethane 397.23
    2-methyl-1-pentanol 91.36
    methyl formate 182.36
    2-methyl-1-butanol 95.47
    n-decane 9.13
    butyronitrile 130.55
    3,7-dimethyl-1-octanol 53.45
    1-chlorooctane 44.06
    1-chlorotetradecane 21.61
    n-nonane 8.17
    undecane 7.16
    tert-butylcyclohexane 15.21
    cyclooctane 7.74
    cyclopentanol 164.57
    tetrahydropyran 257.24
    tert-amyl methyl ether 101.36
    2,5,8-trioxanonane 190.91
    1-hexene 57.87
    2-isopropoxyethanol 109.16
    2,2,2-trifluoroethanol 198.73
    methyl butyrate 165.97

    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