Phenmedipham

Overview IFRA Request a quote

  • Identifiers

    CAS number
    13684-63-4

    Molecular formula
    C16H16N2O4

    SMILES
    CC1=CC(=CC=C1)NC(=O)OC2=CC=CC(=C2)NC(=O)OC

    Safety labels

    Environmental Hazard
    Environmental

  • Odor profile

    Fruity 47.99%
    Grape 46.01%
    Odorless 32.49%
    Floral 30.3%
    Honey 29.31%
    Animal 28.38%
    Cooked 25.15%
    Citrus 23.33%
    Cheesy 22.98%
    Meaty 21.81%

    Scent© AI

  • Properties

    XLogP3-AA
    3.6

    pKa est.
    7.54 (neutral)

    Molecular weight
    300.31 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    630°C

    Melting point expt.

    • 289 to 291 °F (NTP, 1992)
    • 139-142 (143-144 °C)

    Flash point est.
    191.17 ˚C

    Flash point expt.

    • 74 °C CC

    Solubility expt.

    • less than 1 mg/mL at 70 °F (NTP, 1992)
    • COLORLESS, ODORLESS, CRYSTALLINE SOLID; MP 143-144 °C; SOLUBILITY: 1 MG/L WATER AT 20 °C, ACETONE 20%, CYCLOHEXANONE 20%, METHANOL 5% /TECHNICAL MATERIAL 97% PURE/
    • 4.7 MG/L WATER; ABOUT 200 G/KG IN ACETONE, CYCLOHEXANONE; ABOUT 50 G/KG IN METHANOL; 20 G/KG IN CHLOROFORM; 2.5 G/KG IN BENZENE; ABOUT 500 MG/KG IN HEXENE AT ROOM TEMP

  • Synonyms

    • Phenmedipham
    • 13684-63-4
    • 3-((Methoxycarbonyl)amino)phenyl m-tolylcarbamate
    • BETANAL
    • Fenmedifam
    • Spin-aid
    • Phenmediphame
    • Kemifam
    • Synbetan P
    • Schering 4072
    • Schering-38584
    • [3-(methoxycarbonylamino)phenyl] N-(3-methylphenyl)carbamate
    • Phenmedipham [ISO]
    • Phenmediphame [ISO-French]
    • Methyl 3-(3-methylcarbaniloyloxy)carbanilate
    • Beetomax
    • Betosip
    • CCRIS 6091
    • Alegro
    • Beetup
    • Fender
    • Gusto
    • Phenmedipham [ANSI:BSI:ISO]
    • Tripart beta
    • HSDB 1402
    • Betanal E
    • Protrum K
    • Kemifam FL
    • UNII-UJE31KXP78
    • EINECS 237-199-0
    • EP-452
    • EPA Pesticide Chemical Code 098701
    • SN 4075
    • BRN 2395027
    • Betamix (Salt/Mix)
    • DTXSID1024255
    • Medipham (Salt/Mix)
    • SN-38584
    • CHEBI:81734
    • Methyl 3-(m-tolylcarbamoyloxy)phenylcarbamate
    • 3-((Methoxycarbonyl)amino)phenyl (3-methylphenyl)carbamate
    • 3-(Carbomethoxyamino)phenyl 3-methylcarbanilate
    • PHENMEDIPHAM [MI]
    • Synbetan mix (Salt/Mix)
    • Betanal tandem (Salt/Mix)
    • PHENMEDIPHAM [HSDB]
    • Betanal compact (Salt/Mix)
    • UJE31KXP78
    • Carbamic acid, (3-methylphenyl)-, 3-((methoxycarbonyl)amino)phenyl ester
    • 3-Methoxycarbonylaminophenyl N-3'-methylphenylcarbamate
    • m-Hydroxycarbanilic acid methyl ester m-methylcarbanilate
    • DTXCID304255
    • 3-[(Methoxycarbonyl)amino]phenyl (3-methylphenyl)carbamate
    • CHEMBL1079421
    • 3-[(Methoxycarbonyl)amino]phenyl N-(3-methylphenyl)carbamate
    • 3-Methoxycarbonyl-N-(3'-methylphenyl)-carbamat
    • 3-(Methylphenyl)carbamic acid 3-((methoxycarbonyl)amino)phenyl ester
    • Carbamic acid, (3-methylphenyl)-, 3-[(methoxycarbonyl)amino]phenyl ester
    • Carbanilic acid, m-hydroxy-, methyl ester, m-methylcarbanilate (ester)
    • Ethofumesate-phenmedipham (Salt/Mix)
    • 3-(methoxyformamido)phenyl (3-methylphenyl)carbamate
    • SN 38584
    • Carbanilic acid, m-hydroxy-, methyl ester, m-methylcarbanilate
    • Methyl N-(3-(N-(3-methylphenyl)carbamoyloxy)phenyl)carbamate
    • Methyl m-hydroxycarbanilate m-methylcarbanilate
    • 3-methoxycarbonyl-N-(3'-methylphenyl)-carbamate
    • Phenmediphame (ISO-French)
    • METHYL-M-HYDROXYCARBANILATE-M-METHYLCARBANILATE
    • Phenmedipham (ANSI:BSI:ISO)
    • Caswell No. 648B
    • Morton EP 452
    • 3-((METHOXYCARBONYL)AMINO)PHENYL N-(3-METHYLPHENYL)CARBAMATE
    • 3-((Methoxycarbonyl)amino)phenyl N-(3-methylphenyl)carbamate (Phenmedipham)
    • CAS-13684-63-4
    • Phendipham
    • Betaflow
    • Betalion
    • Medipham
    • Spinaid
    • Vanguard
    • Methyl N-[3-[N-(3-methylphenyl)carbamoyloxy]phenyl]carbamate
    • Pistol
    • Suplex
    • Methyl-3-m-tolycarbamoloxyphenyl carbamate
    • Headland dephend
    • Tripart beta 2
    • Methyl-3-hydroxycarbanilate-3-methylcarbanilate
    • 1-3-((hydroxy(methoxy)methylidene)amino)phenoxy-N-(3-methylphenyl)methanimidic acid
    • 1-3-{[hydroxy(methoxy)methylidene]amino}phenoxy-N-(3-methylphenyl)methanimidic acid
    • Methyl m-hydroxycarbanilate, m-methylcarbanilate
    • S 4075
    • 3-Methoxycarbonylaminophenyl 3'-methylcarbanilate
    • STEPHAM
    • Schering38584
    • Pistol 400
    • 3-Methoxycarbonyl-N-(3'-methylphenyl)-carbamat [German]
    • Ethofumesate-phenmedipham
    • Carbanilic acid, m-hydroxy, methyl ester, m-methylcarbanilate (ester)
    • SCHEMBL54580
    • Methyl m-hydroxycarbanilate m-methylcarbanilate (ester)
    • EP452
    • HY-B2032
    • Tox21_201295
    • Tox21_303044
    • BDBM50311785
    • AKOS015895890
    • Methyl3mtolycarbamoloxyphenyl carbamate
    • DS-2923
    • SN38584
    • NCGC00090870-01
    • NCGC00090870-02
    • NCGC00257194-01
    • NCGC00258847-01
    • 3MethoxycarbonylN(3'methylphenyl)carbamat
    • AC-37611
    • DA-66663
    • Methanol, 1-(3-(((1E)-hydroxymethoxymethylene)amino)phenoxy)-1-((3-methylphenyl)imino)-, (E)-
    • Methyl 3(3methylcarbaniloyloxy)carbanilate
    • Methyl3hydroxycarbanilate3methylcarbanilate
    • Methyl 3(mtolylcarbamoyloxy)phenylcarbamate
    • DB-042361
    • 3(Carbomethoxyamino)phenyl 3methylcarbanilate
    • CS-0014127
    • Methyl mhydroxycarbanilate, mmethylcarbanilate
    • NS00001690
    • 3Methoxycarbonylaminophenyl 3'methylcarbanilate
    • Methyl-3-(3-methylcarbaniloyloxy) carbanilate
    • C18420

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 16.01
    methanol 26.03
    isopropanol 8.06
    water 0.19
    ethyl acetate 12.55
    n-propanol 11.92
    acetone 44.09
    n-butanol 8.01
    acetonitrile 13.22
    DMF 334.71
    toluene 0.62
    isobutanol 6.44
    1,4-dioxane 30.29
    methyl acetate 19.64
    THF 125.18
    2-butanone 24.13
    n-pentanol 7.31
    sec-butanol 7.33
    n-hexane 0.04
    ethylene glycol 14.31
    NMP 175.29
    cyclohexane 0.02
    DMSO 368.96
    n-butyl acetate 9.33
    n-octanol 3.72
    chloroform 8.51
    n-propyl acetate 11.2
    acetic acid 62.61
    dichloromethane 9.21
    cyclohexanone 28.06
    propylene glycol 36.75
    isopropyl acetate 7.94
    DMAc 308.6
    2-ethoxyethanol 51.65
    isopentanol 6.82
    n-heptane 0.06
    ethyl formate 14.55
    1,2-dichloroethane 6.7
    n-hexanol 3.14
    2-methoxyethanol 136.7
    isobutyl acetate 6.59
    tetrachloromethane 0.39
    n-pentyl acetate 6.0
    transcutol 138.21
    n-heptanol 3.69
    ethylbenzene 0.58
    MIBK 9.21
    2-propoxyethanol 50.78
    tert-butanol 9.62
    MTBE 3.13
    2-butoxyethanol 22.24
    propionic acid 29.56
    o-xylene 0.6
    formic acid 53.86
    diethyl ether 2.59
    m-xylene 0.74
    p-xylene 1.1
    chlorobenzene 2.4
    dimethyl carbonate 29.31
    n-octane 0.05
    formamide 92.95
    cyclopentanone 79.57
    2-pentanone 14.43
    anisole 6.66
    cyclopentyl methyl ether 8.07
    gamma-butyrolactone 113.19
    1-methoxy-2-propanol 92.94
    pyridine 15.66
    3-pentanone 8.95
    furfural 71.8
    n-dodecane 0.1
    diethylene glycol 58.29
    diisopropyl ether 0.64
    tert-amyl alcohol 7.15
    acetylacetone 37.61
    n-hexadecane 0.11
    acetophenone 12.21
    methyl propionate 23.68
    isopentyl acetate 9.15
    trichloroethylene 18.37
    n-nonanol 4.14
    cyclohexanol 3.82
    benzyl alcohol 10.52
    2-ethylhexanol 2.29
    isooctanol 3.36
    dipropyl ether 3.15
    1,2-dichlorobenzene 3.32
    ethyl lactate 21.34
    propylene carbonate 41.58
    n-methylformamide 92.31
    2-pentanol 3.28
    n-pentane 0.03
    1-propoxy-2-propanol 31.72
    1-methoxy-2-propyl acetate 27.22
    2-(2-methoxypropoxy) propanol 36.18
    mesitylene 0.51
    ε-caprolactone 32.32
    p-cymene 0.92
    epichlorohydrin 87.25
    1,1,1-trichloroethane 2.91
    2-aminoethanol 29.98
    morpholine-4-carbaldehyde 128.42
    sulfolane 170.82
    2,2,4-trimethylpentane 0.05
    2-methyltetrahydrofuran 19.3
    n-hexyl acetate 9.6
    isooctane 0.04
    2-(2-butoxyethoxy)ethanol 42.11
    sec-butyl acetate 6.11
    tert-butyl acetate 10.4
    decalin 0.06
    glycerin 73.11
    diglyme 71.32
    acrylic acid 38.46
    isopropyl myristate 4.53
    n-butyric acid 23.17
    acetyl acetate 11.5
    di(2-ethylhexyl) phthalate 8.5
    ethyl propionate 11.14
    nitromethane 155.2
    1,2-diethoxyethane 16.21
    benzonitrile 8.59
    trioctyl phosphate 5.2
    1-bromopropane 1.46
    gamma-valerolactone 132.21
    n-decanol 3.25
    triethyl phosphate 8.41
    4-methyl-2-pentanol 2.53
    propionitrile 9.07
    vinylene carbonate 33.78
    1,1,2-trichlorotrifluoroethane 80.31
    DMS 18.63
    cumene 0.63
    2-octanol 2.31
    2-hexanone 11.64
    octyl acetate 6.49
    limonene 0.99
    1,2-dimethoxyethane 66.79
    ethyl orthosilicate 6.6
    tributyl phosphate 6.72
    diacetone alcohol 29.59
    N,N-dimethylaniline 5.32
    acrylonitrile 19.2
    aniline 4.72
    1,3-propanediol 36.15
    bromobenzene 1.76
    dibromomethane 3.27
    1,1,2,2-tetrachloroethane 16.44
    2-methyl-cyclohexyl acetate 9.65
    tetrabutyl urea 11.75
    diisobutyl methanol 1.93
    2-phenylethanol 9.0
    styrene 0.81
    dioctyl adipate 11.07
    dimethyl sulfate 69.78
    ethyl butyrate 9.42
    methyl lactate 47.16
    butyl lactate 14.59
    diethyl carbonate 8.28
    propanediol butyl ether 29.01
    triethyl orthoformate 9.08
    p-tert-butyltoluene 0.87
    methyl 4-tert-butylbenzoate 20.92
    morpholine 51.77
    tert-butylamine 1.84
    n-dodecanol 2.38
    dimethoxymethane 106.52
    ethylene carbonate 23.87
    cyrene 46.54
    2-ethoxyethyl acetate 15.97
    2-ethylhexyl acetate 6.11
    1,2,4-trichlorobenzene 5.51
    4-methylpyridine 12.39
    dibutyl ether 3.58
    2,6-dimethyl-4-heptanol 1.93
    DEF 32.17
    dimethyl isosorbide 61.76
    tetrachloroethylene 5.84
    eugenol 23.41
    triacetin 24.23
    span 80 24.53
    1,4-butanediol 14.73
    1,1-dichloroethane 3.66
    2-methyl-1-pentanol 5.84
    methyl formate 62.87
    2-methyl-1-butanol 6.52
    n-decane 0.13
    butyronitrile 7.95
    3,7-dimethyl-1-octanol 3.62
    1-chlorooctane 0.89
    1-chlorotetradecane 0.51
    n-nonane 0.1
    undecane 0.11
    tert-butylcyclohexane 0.07
    cyclooctane 0.01
    cyclopentanol 9.81
    tetrahydropyran 7.44
    tert-amyl methyl ether 3.56
    2,5,8-trioxanonane 56.9
    1-hexene 0.38
    2-isopropoxyethanol 26.11
    2,2,2-trifluoroethanol 22.27
    methyl butyrate 16.09

    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