N-benzoylanthranilic acid

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  • Identifiers

    CAS number
    579-93-1

    Molecular formula
    C14H11NO3

    SMILES
    C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)O

    Safety labels

    Irritant
    Irritant

  • Odor profile

    Fragrance
    Fruity 67.38%
    Grape 50.83%
    Odorless 32.05%
    Balsamic 30.32%
    Honey 28.02%
    Bitter 27.87%
    Cooked 24.83%
    Floral 24.82%
    Berry 24.26%
    Citrus 23.07%

     

    Flavor
    Odorless 49.53%
    Mild 39.39%
    Bitter 36.61%
    Faint 30.25%
    Balsam 27.27%
    Sour 26.79%
    Nutty 26.41%
    Honey 26.21%
    Fruity 25.18%
    Very mild 24.17%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    3.5

    pKa est.
    7.09 (neutral)

    Molecular weight
    241.24 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Melting point expt.

    • 183.00 °C. @ 760.00 mm Hg

    Boiling point

    • 341.00 to 342.00 °C. @ 760.00 mm Hg

    Flash point

    • 210.47 ˚C est.

    Solubility expt.

    • slightly
    • Slightly soluble in water
    • Soluble (in ethanol)

  • Synonyms

    • 2-(Benzoylamino)benzoic acid
    • 579-93-1
    • 2-benzamidobenzoic acid
    • N-Benzoylanthranilic acid
    • dianthramid B
    • Benzoic acid, 2-(benzoylamino)-
    • 2-Benzoylamino-benzoic acid
    • 2'-Carboxybenzanilide
    • Benzoylanthranilic acid
    • N-BENZOYLANTHRANILICACID
    • benzoyl anthranilic acid
    • 2-(Benzoylamino)-Benzoic Acid
    • DIANTHRAMIDE B
    • CHEBI:50037
    • o-benzamidobenzoic acid
    • 2-benzamido-benzoic acid
    • NSC-3866
    • MFCD00444173
    • 2-Benzoylaminobenzoic acid
    • 2-[(phenylcarbonyl)amino]benzoic acid
    • UNII-6085493379
    • Anthranilic acid, N-benzoyl-
    • N-(2-Carboxyphenyl)benzamide
    • MLS000067165
    • FEMA NO. 4078
    • DTXSID40206620
    • 2-(BENZAMIDO)BENZOIC ACID
    • NSC 3866
    • N-BENZOYLANTHRANILIC ACID [FHFI]
    • SMR000124671
    • 2-((Phenylcarbonyl)amino)benzoic acid
    • O-Benzamidobenzoate
    • 2"-Carboxybenzanilide
    • 2-benzoylaminobenzoate
    • ChemDiv2_000185
    • Cambridge id 5137113
    • Oprea1_215602
    • Oprea1_745245
    • CBDivE_013145
    • cid_68482
    • SCHEMBL414754
    • CHEMBL198666
    • SCHEMBL11409316
    • BDBM40663
    • DTXCID70129111
    • NSC3866
    • HMS1369I09
    • HMS2502I11
    • ALBB-013689
    • BBL013415
    • STK362118
    • AKOS000117746
    • CS-W021424
    • FS-3206
    • NCGC00245456-01
    • SY027851
    • NS00022413
    • EN300-07527
    • C03141
    • AB00450592-08
    • SR-01000389179
    • SR-01000389179-1
    • Q27121845
    • Z57128272
    • 611-604-4

  • Applications

    N-benzoylanthranilic acid (CAS 579-93-1) is mainly used as an organic synthesis intermediate, serving as a protected anthranilic acid building block for subsequent transformations. It is commonly utilized in pharmaceutical and, to a degree, agrochemical manufacturing as a starting point to construct amide and heterocyclic frameworks. The compound also functions as a dye/pigment intermediate, enabling downstream synthesis of colorants for coatings and inks. In polymer and materials science, it can serve as a building block for specialty monomers and functional intermediates. In research and development, it provides a versatile starting material for exploratory chemistry and process optimization.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 27.74
    methanol 31.11
    isopropanol 14.61
    water 0.03
    ethyl acetate 16.75
    n-propanol 25.88
    acetone 27.65
    n-butanol 19.13
    acetonitrile 5.57
    DMF 436.99
    toluene 3.25
    isobutanol 10.74
    1,4-dioxane 35.89
    methyl acetate 24.91
    THF 121.03
    2-butanone 50.71
    n-pentanol 14.4
    sec-butanol 19.04
    n-hexane 0.05
    ethylene glycol 8.95
    NMP 195.27
    cyclohexane 0.03
    DMSO 337.11
    n-butyl acetate 18.03
    n-octanol 3.59
    chloroform 1.97
    n-propyl acetate 14.15
    acetic acid 22.22
    dichloromethane 1.28
    cyclohexanone 48.66
    propylene glycol 21.36
    isopropyl acetate 14.85
    DMAc 438.8
    2-ethoxyethanol 43.35
    isopentanol 15.9
    n-heptane 0.08
    ethyl formate 9.75
    1,2-dichloroethane 4.49
    n-hexanol 12.08
    2-methoxyethanol 122.09
    isobutyl acetate 5.86
    tetrachloromethane 0.26
    n-pentyl acetate 8.34
    transcutol 182.37
    n-heptanol 6.99
    ethylbenzene 2.18
    MIBK 21.07
    2-propoxyethanol 51.08
    tert-butanol 20.15
    MTBE 11.25
    2-butoxyethanol 27.72
    propionic acid 22.66
    o-xylene 3.07
    formic acid 19.41
    diethyl ether 6.99
    m-xylene 2.83
    p-xylene 2.47
    chlorobenzene 2.93
    dimethyl carbonate 22.48
    n-octane 0.04
    formamide 62.51
    cyclopentanone 96.27
    2-pentanone 33.3
    anisole 13.89
    cyclopentyl methyl ether 23.94
    gamma-butyrolactone 90.93
    1-methoxy-2-propanol 100.21
    pyridine 28.04
    3-pentanone 21.23
    furfural 59.47
    n-dodecane 0.12
    diethylene glycol 47.36
    diisopropyl ether 1.91
    tert-amyl alcohol 21.11
    acetylacetone 41.36
    n-hexadecane 0.14
    acetophenone 19.6
    methyl propionate 31.99
    isopentyl acetate 15.37
    trichloroethylene 12.25
    n-nonanol 4.27
    cyclohexanol 12.16
    benzyl alcohol 17.31
    2-ethylhexanol 6.79
    isooctanol 6.11
    dipropyl ether 6.56
    1,2-dichlorobenzene 3.74
    ethyl lactate 18.73
    propylene carbonate 29.7
    n-methylformamide 86.45
    2-pentanol 11.54
    n-pentane 0.04
    1-propoxy-2-propanol 36.23
    1-methoxy-2-propyl acetate 35.45
    2-(2-methoxypropoxy) propanol 36.19
    mesitylene 1.79
    ε-caprolactone 45.99
    p-cymene 2.56
    epichlorohydrin 78.58
    1,1,1-trichloroethane 2.0
    2-aminoethanol 29.45
    morpholine-4-carbaldehyde 119.87
    sulfolane 167.55
    2,2,4-trimethylpentane 0.2
    2-methyltetrahydrofuran 40.12
    n-hexyl acetate 10.98
    isooctane 0.15
    2-(2-butoxyethoxy)ethanol 50.61
    sec-butyl acetate 10.71
    tert-butyl acetate 20.47
    decalin 0.17
    glycerin 51.03
    diglyme 91.12
    acrylic acid 23.91
    isopropyl myristate 5.39
    n-butyric acid 24.27
    acetyl acetate 9.72
    di(2-ethylhexyl) phthalate 8.03
    ethyl propionate 14.61
    nitromethane 64.84
    1,2-diethoxyethane 25.37
    benzonitrile 10.92
    trioctyl phosphate 5.57
    1-bromopropane 1.29
    gamma-valerolactone 120.63
    n-decanol 3.44
    triethyl phosphate 9.56
    4-methyl-2-pentanol 7.61
    propionitrile 9.53
    vinylene carbonate 22.13
    1,1,2-trichlorotrifluoroethane 62.4
    DMS 18.49
    cumene 1.89
    2-octanol 3.43
    2-hexanone 18.79
    octyl acetate 7.1
    limonene 3.83
    1,2-dimethoxyethane 68.63
    ethyl orthosilicate 8.36
    tributyl phosphate 6.64
    diacetone alcohol 48.99
    N,N-dimethylaniline 11.45
    acrylonitrile 18.25
    aniline 12.65
    1,3-propanediol 38.89
    bromobenzene 1.82
    dibromomethane 0.69
    1,1,2,2-tetrachloroethane 15.29
    2-methyl-cyclohexyl acetate 12.26
    tetrabutyl urea 12.01
    diisobutyl methanol 5.02
    2-phenylethanol 17.1
    styrene 2.47
    dioctyl adipate 11.17
    dimethyl sulfate 52.71
    ethyl butyrate 13.81
    methyl lactate 44.03
    butyl lactate 16.02
    diethyl carbonate 8.76
    propanediol butyl ether 27.49
    triethyl orthoformate 11.73
    p-tert-butyltoluene 2.61
    methyl 4-tert-butylbenzoate 21.42
    morpholine 78.94
    tert-butylamine 5.96
    n-dodecanol 2.69
    dimethoxymethane 107.07
    ethylene carbonate 16.15
    cyrene 37.36
    2-ethoxyethyl acetate 20.16
    2-ethylhexyl acetate 10.91
    1,2,4-trichlorobenzene 6.78
    4-methylpyridine 24.62
    dibutyl ether 4.92
    2,6-dimethyl-4-heptanol 5.02
    DEF 65.15
    dimethyl isosorbide 54.33
    tetrachloroethylene 6.37
    eugenol 24.67
    triacetin 20.42
    span 80 25.05
    1,4-butanediol 10.64
    1,1-dichloroethane 1.56
    2-methyl-1-pentanol 13.8
    methyl formate 31.42
    2-methyl-1-butanol 16.45
    n-decane 0.14
    butyronitrile 9.14
    3,7-dimethyl-1-octanol 5.29
    1-chlorooctane 1.07
    1-chlorotetradecane 0.64
    n-nonane 0.09
    undecane 0.13
    tert-butylcyclohexane 0.22
    cyclooctane 0.02
    cyclopentanol 17.76
    tetrahydropyran 20.1
    tert-amyl methyl ether 13.58
    2,5,8-trioxanonane 66.19
    1-hexene 0.67
    2-isopropoxyethanol 25.41
    2,2,2-trifluoroethanol 8.7
    methyl butyrate 20.23

    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