Fenticlor

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  • Identifiers

    CAS number
    97-24-5

    Molecular formula
    C12H8Cl2O2S

    SMILES
    C1=CC(=C(C=C1Cl)SC2=C(C=CC(=C2)Cl)O)O

    Safety labels

    Corrosive
    Corrosive

    Irritant
    Irritant

  • Odor profile

    Fragrance
    Meaty 56.14%
    Burnt 45.99%
    Phenolic 44.61%
    Smoky 36.62%
    Savory 33.98%
    Odorless 33.56%
    Roasted 32.91%
    Sulfurous 31.01%
    Cooked 26.44%
    Spicy 22.83%

     

    Flavor
    Bitter 60.09%
    Mild 27.6%
    Meaty 25.66%
    Odorless 24.51%
    Roasted 21.47%
    Scallion 21.07%
    Very strong 20.64%
    Nitrile 19.99%
    Indole 19.85%
    Sweet-like 19.84%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    4.5

    pKa est.
    10.32 (weak base)

    Molecular weight
    287.2 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    419°C

    Melting point expt.

    • 348.4 to 368.2 °F (NTP, 1992)

    Flash point

    • 202.38 ˚C est.

    Solubility expt.

    • less than 1 mg/mL at 72 °F (NTP, 1992)

  • Synonyms

    • Fenticlor
    • 97-24-5
    • 2,2'-THIOBIS(4-CHLOROPHENOL)
    • Bis(2-hydroxy-5-chlorophenyl) sulfide
    • Fentichlor
    • Novex
    • Phentichlorum
    • Meflorin
    • Ovitrol
    • Fenticloro
    • Oksid
    • Bis(2-hydroxy-5-chlorophenyl)sulfide
    • Fenticlorum
    • D 25-Antimykotikum
    • S 7 (antimycotic)
    • Phenol, 2,2'-thiobis[4-chloro-
    • 2,2'-Dihydroxy-5,5'-dichlorodiphenyl sulfide
    • Ph 549
    • Caswell No. 851
    • 2,2'-Dihydroxy-5,5'-dichlorophenyl sulfide
    • 5,5'-Dichloro-2,2'-dihydroxydiphenyl sulfide
    • CR 305
    • Fenticlorum [INN-Latin]
    • Fenticloro [INN-Spanish]
    • HL 1050
    • NSC-4112
    • Phenol, 2,2'-thiobis(4-chloro-
    • 2,2'-Thiobis4-chlorophenol
    • Fenticlor [USAN:INN:BAN]
    • NSC 55636
    • NSC-55636
    • 2,2'-sulfanediylbis(4-chlorophenol)
    • CCRIS 4731
    • CHEBI:556580
    • D 25
    • 4-chloro-2-(5-chloro-2-hydroxyphenyl)sulfanylphenol
    • NSC 4112
    • NSC55636
    • EINECS 202-568-7
    • EPA Pesticide Chemical Code 064209
    • BRN 2057140
    • 2,2'-Thiobis[4-chlorophenol]
    • DTXSID4026137
    • S 7
    • AI3-08456
    • D61659OVD0
    • FENTICLOR [INN]
    • FENTICLOR [MI]
    • FENTICLOR [USAN]
    • FENTICLOR [MART.]
    • FENTICLOR [WHO-DD]
    • MLS002415676
    • DTXCID506137
    • NSC4112
    • 4,4'-dichloro-2,2'-thiodiphenol
    • 4-06-00-05645 (Beilstein Handbook Reference)
    • component of Banish
    • 4-chloro-2-[(5-chloro-2-hydroxyphenyl)sulfanyl]phenol
    • Bis(5-chloro-2-hydroxyphenyl) Sulfide
    • NCGC00013679-02
    • SMR000145265
    • Fenticlorum (INN-Latin)
    • Fenticloro (INN-Spanish)
    • FENTICLOR (MART.)
    • 2,5'-dichlorophenyl sulfide
    • 2,5'-dichlorodiphenyl sulfide
    • Phenol,2'-thiobis[4-chloro-
    • WLN: QR DG BSR BQ EG
    • 5,2'-dihydroxydiphenyl sulfide
    • Fentichlor; Fenticlor; HL 1050; Meflorin; NSC 4112
    • CAS-97-24-5
    • S-7
    • S 7 (VAN)
    • D 25 (VAN)
    • UNII-D61659OVD0
    • D 25Antimykotikum
    • MFCD00031479
    • Fenticlor (USAN/INN)
    • Epitope ID:131793
    • cid_7329
    • NCIStruc1_000386
    • NCIStruc2_000549
    • TimTec1_002292
    • 4-chloro-2-(5-chloro-2-hydroxyphenylthio)phenol
    • Oprea1_024834
    • Oprea1_589846
    • SCHEMBL23276
    • 2,2'Thiobis(4chlorophenol)
    • Phenol, 2,2'thiobis(4chloro
    • CHEMBL473535
    • 4-chloro-2-(5-chloro-2-hydroxy-phenyl)sulfanyl-phenol
    • component of Banish (Salt/Mix)
    • ANUSOIHIIPAHJV-UHFFFAOYSA-
    • BDBM80984
    • Bis(2hydroxy5chlorophenyl)sulfide
    • Bis(2hydroxy5chlorophenyl) sulfide
    • HMS1540I04
    • KUC106499N
    • ALBB-012859
    • NCI55636
    • Tox21_110031
    • Tox21_200961
    • BBL003411
    • CCG-37773
    • NCGC00013679
    • STK048543
    • AKOS000491331
    • Tox21_110031_1
    • KSC-19-058
    • 2,2'Dihydroxy5,5'dichlorophenyl sulfide
    • NCGC00013679-03
    • NCGC00013679-04
    • NCGC00013679-06
    • NCGC00091879-01
    • NCGC00091879-02
    • NCGC00258514-01
    • AS-13478
    • NCI60_004363
    • 2,2'Dihydroxy5,5'dichlorodiphenyl sulfide
    • 5,5'Dichloro2,2'dihydroxydiphenyl sulfide
    • DB-022656
    • B0850
    • NS00001597
    • 2,2'-THIOBIS(4-CHLOROPHENOL) [INCI]
    • D04164
    • D88702
    • EN300-220348
    • SR-01000878241

  • Applications

    Fenticlor (CAS 97-24-5) is used primarily as an aroma-related chemical in perfumery and fragrance formulations, functioning as an odorant and, in some systems, as a minor fragrance fixative. It is commonly evaluated as an intermediate or specialty solvent in organic synthesis and may appear in cosmetic and personal care products as a fragrance component. In household and cleaning products it can serve as a perfuming additive, contributing to scent profiles. In industrial manufacturing, coatings and inks it is used as a fragrance ingredient or processing aid, and it may have applications in polymers or plastics formulations where scent or formulation compatibility is desired, all subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 8.47
    methanol 4.39
    isopropanol 5.6
    water 0.02
    ethyl acetate 30.63
    n-propanol 9.59
    acetone 30.75
    n-butanol 7.83
    acetonitrile 9.67
    DMF 107.55
    toluene 9.96
    isobutanol 5.41
    1,4-dioxane 65.47
    methyl acetate 40.21
    THF 251.37
    2-butanone 60.64
    n-pentanol 10.26
    sec-butanol 13.06
    n-hexane 0.21
    ethylene glycol 2.42
    NMP 70.29
    cyclohexane 0.34
    DMSO 28.53
    n-butyl acetate 38.0
    n-octanol 10.57
    chloroform 18.88
    n-propyl acetate 30.75
    acetic acid 13.09
    dichloromethane 12.29
    cyclohexanone 56.24
    propylene glycol 5.49
    isopropyl acetate 26.97
    DMAc 179.87
    2-ethoxyethanol 39.78
    isopentanol 7.94
    n-heptane 1.55
    ethyl formate 17.65
    1,2-dichloroethane 10.13
    n-hexanol 13.1
    2-methoxyethanol 45.02
    isobutyl acetate 19.0
    tetrachloromethane 1.35
    n-pentyl acetate 25.88
    transcutol 100.22
    n-heptanol 11.08
    ethylbenzene 8.72
    MIBK 22.83
    2-propoxyethanol 47.64
    tert-butanol 11.32
    MTBE 28.49
    2-butoxyethanol 31.58
    propionic acid 10.59
    o-xylene 8.91
    formic acid 4.98
    diethyl ether 13.87
    m-xylene 7.21
    p-xylene 10.27
    chlorobenzene 9.23
    dimethyl carbonate 21.59
    n-octane 0.78
    formamide 21.68
    cyclopentanone 106.52
    2-pentanone 33.37
    anisole 43.48
    cyclopentyl methyl ether 40.25
    gamma-butyrolactone 99.13
    1-methoxy-2-propanol 38.26
    pyridine 56.84
    3-pentanone 28.35
    furfural 78.24
    n-dodecane 0.82
    diethylene glycol 27.54
    diisopropyl ether 6.64
    tert-amyl alcohol 19.42
    acetylacetone 52.14
    n-hexadecane 0.97
    acetophenone 43.11
    methyl propionate 32.03
    isopentyl acetate 34.39
    trichloroethylene 47.67
    n-nonanol 11.77
    cyclohexanol 12.76
    benzyl alcohol 26.28
    2-ethylhexanol 13.96
    isooctanol 10.61
    dipropyl ether 27.05
    1,2-dichlorobenzene 10.64
    ethyl lactate 20.68
    propylene carbonate 44.42
    n-methylformamide 27.93
    2-pentanol 8.03
    n-pentane 0.19
    1-propoxy-2-propanol 40.09
    1-methoxy-2-propyl acetate 58.09
    2-(2-methoxypropoxy) propanol 44.65
    mesitylene 5.06
    ε-caprolactone 57.8
    p-cymene 11.28
    epichlorohydrin 101.87
    1,1,1-trichloroethane 11.21
    2-aminoethanol 6.61
    morpholine-4-carbaldehyde 98.23
    sulfolane 64.88
    2,2,4-trimethylpentane 0.83
    2-methyltetrahydrofuran 82.26
    n-hexyl acetate 24.79
    isooctane 0.44
    2-(2-butoxyethoxy)ethanol 48.06
    sec-butyl acetate 25.8
    tert-butyl acetate 38.1
    decalin 0.98
    glycerin 11.02
    diglyme 95.69
    acrylic acid 11.29
    isopropyl myristate 15.83
    n-butyric acid 14.91
    acetyl acetate 21.06
    di(2-ethylhexyl) phthalate 15.07
    ethyl propionate 27.91
    nitromethane 45.26
    1,2-diethoxyethane 51.15
    benzonitrile 22.45
    trioctyl phosphate 10.8
    1-bromopropane 6.1
    gamma-valerolactone 140.88
    n-decanol 9.41
    triethyl phosphate 20.59
    4-methyl-2-pentanol 7.29
    propionitrile 11.34
    vinylene carbonate 35.82
    1,1,2-trichlorotrifluoroethane 63.48
    DMS 29.95
    cumene 6.3
    2-octanol 9.79
    2-hexanone 34.57
    octyl acetate 17.51
    limonene 14.74
    1,2-dimethoxyethane 97.4
    ethyl orthosilicate 21.55
    tributyl phosphate 13.07
    diacetone alcohol 41.11
    N,N-dimethylaniline 31.49
    acrylonitrile 17.1
    aniline 17.91
    1,3-propanediol 10.66
    bromobenzene 7.69
    dibromomethane 5.67
    1,1,2,2-tetrachloroethane 33.96
    2-methyl-cyclohexyl acetate 31.83
    tetrabutyl urea 23.27
    diisobutyl methanol 11.8
    2-phenylethanol 28.6
    styrene 9.8
    dioctyl adipate 24.64
    dimethyl sulfate 35.78
    ethyl butyrate 36.55
    methyl lactate 22.95
    butyl lactate 24.16
    diethyl carbonate 23.86
    propanediol butyl ether 26.67
    triethyl orthoformate 34.33
    p-tert-butyltoluene 11.56
    methyl 4-tert-butylbenzoate 36.57
    morpholine 87.42
    tert-butylamine 5.7
    n-dodecanol 7.4
    dimethoxymethane 66.78
    ethylene carbonate 25.31
    cyrene 54.65
    2-ethoxyethyl acetate 42.95
    2-ethylhexyl acetate 28.96
    1,2,4-trichlorobenzene 17.69
    4-methylpyridine 45.98
    dibutyl ether 19.43
    2,6-dimethyl-4-heptanol 11.8
    DEF 49.45
    dimethyl isosorbide 93.61
    tetrachloroethylene 15.87
    eugenol 38.58
    triacetin 36.89
    span 80 31.49
    1,4-butanediol 5.59
    1,1-dichloroethane 8.92
    2-methyl-1-pentanol 11.77
    methyl formate 24.2
    2-methyl-1-butanol 9.4
    n-decane 1.35
    butyronitrile 11.76
    3,7-dimethyl-1-octanol 12.56
    1-chlorooctane 6.37
    1-chlorotetradecane 3.0
    n-nonane 1.08
    undecane 1.03
    tert-butylcyclohexane 1.11
    cyclooctane 0.31
    cyclopentanol 16.53
    tetrahydropyran 49.54
    tert-amyl methyl ether 31.82
    2,5,8-trioxanonane 71.91
    1-hexene 2.34
    2-isopropoxyethanol 29.79
    2,2,2-trifluoroethanol 7.99
    methyl butyrate 34.56

    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