Perphenazine

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  • Identifiers

    CAS number
    58-39-9

    Molecular formula
    C21H26ClN3OS

    SMILES
    C1CN(CCN1CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)CCO

    Safety labels

    Corrosive
    Corrosive

    Acute Toxic
    Acute Toxic

    Irritant
    Irritant

    Health Hazard
    Health

  • Odor profile

    Fragrance
    Odorless 48.44%
    Fishy 39.92%
    Meaty 35.09%
    Animal 31.05%
    Savory 28.28%
    Cheesy 26.9%
    Cooked 26.84%
    Roasted 25.72%
    Ripe 23.51%
    Burnt 21.63%

     

    Flavor
    Bitter 69.22%
    Odorless 27.63%
    Roasted 22.28%
    Sweet-like 21.38%
    Alkaline 21.04%
    Cereal 20.43%
    Bland 20.25%
    Very strong 20.22%
    Scallion 20.15%
    Indole 20.01%

     

    Odor impact est.
    Odorless

  • Properties

    XLogP3-AA
    4.2

    pKa est.
    6.73 (neutral)

    Molecular weight
    404.0 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Melting point expt.

    • 97 °C
    • Crystals from alcohol, MP: 225-226 °C /Dihydrochloride/

    Boiling point

    • 278-281 °C at 1.00E+00 mm Hg
    • BP: 214-218 °C at 0.15 mm Hg; 278-281 at 1 mm Hg

    Flash point

    • 298.0 ˚C est.

    Solubility expt.

    • 28.3 mg/L (at 24 °C)
    • Solubility (mg/mL): ethanol 153; acetone 82; practically insoluble in sesame oil
    • In water, 2.83X10-2 g/L (28.3 mg/L) at 24 °C
    • 2.37e-02 g/L

  • Synonyms

    • perphenazine
    • 58-39-9
    • Trilafon
    • Perphenazin
    • Perfenazine
    • Etaperazine
    • Ethaperazine
    • Etaperazin
    • Fentazin
    • Chlorpiprazine
    • Decentan
    • Perfenazina
    • Perphenan
    • Thilatazin
    • Chlorperphenazine
    • Tranquisan
    • Triphenot
    • Emesinal
    • Trifaron
    • Trilifan
    • F-mon
    • Perphenazinum
    • Sch 3940
    • 2-(4-(3-(2-Chloro-10H-phenothiazin-10-yl)propyl)piperazin-1-yl)ethanol
    • 2-[4-[3-(2-Chlorophenothiazin-10-yl)propyl]piperazin-1-yl]ethanol
    • 4-[3-(2-Chlorophenothiazin-10-yl)propyl]-1-piperazineethanol
    • Perfenazina [INN-Spanish]
    • Perphenazinum [INN-Latin]
    • NSC 150866
    • FTA7XXY4EZ
    • PZC
    • UNII-FTA7XXY4EZ
    • HSDB 3379
    • gamma-(4-(beta-Hydroxyethyl)piperazin-1-yl)propyl-2-chlorophenothiazine
    • 4-(3-(2-Chlorophenothiazin-10-yl)propyl)-1-piperazineethanol
    • EINECS 200-381-5
    • MFCD00056798
    • NSC-150866
    • CHEBI:8028
    • DTXSID1023441
    • 4-[3-(2-Chloro-10H-phenothiazin-10-yl)propyl]-1-piperazineethanol
    • AI3-50151
    • 1-(2-Hydroxyethyl)-4-(3-(2-chloro-10-phenothiazinyl)propyl)piperazine
    • 2-Chloro-10-(3-(4-(2-hydroxyethyl)piperazin-1-yl)propyl)phenothiazine
    • 2-Chloro-10-3-(1-(2-hydroxyethyl)-4-piperazinyl)propyl phenothiazine
    • 2-{4-[3-(2-chloro-10H-phenothiazin-10-yl)propyl]piperazin-1-yl}ethan-1-ol
    • NSC150866
    • CHEMBL567
    • 1',1-(2-Idrossietil)-4,3-(2-cloro-10-fenotiazil)propilpiperazina
    • 1-Piperazineethanol, 4-(3-(2-chloro-10H-phenothiazin-10-yl)propyl)-
    • 2-{4-[3-(2-chloro-10H-phenothiazin-10-yl)propyl]piperazin-1-yl}ethanol
    • 2-Chloro-10-(3-(1-(2-hydroxyethyl)-4-piperazinyl)propyl)phenothiazine
    • 2-Chloro-10-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]phenothiazine
    • MLS000069637
    • DTXCID703441
    • 1-Piperazineethanol, 4-(3-(2-chlorophenothiazin-10-yl)propyl)-
    • Piperazineethanol, 4-(3-(2-chloro-10H-phenothiazin-10-yl)propyl)-
    • Perphenazine [USP:INN:BAN:JAN]
    • 1-Piperazineethanol, 4-[3-(2-chloro-10H-phenothiazin-10-yl)propyl]-
    • 2-(4-[3-(2-Chloro-10H-phenothiazin-10-yl)propyl]-1-piperazinyl)ethanol
    • ETRAFON-A COMPONENT PERPHENAZINE
    • CAS-58-39-9
    • NCGC00015826-02
    • Perfenil
    • SMR000058180
    • Perfenazina [Italian]
    • 1-(2-Hydroxyethyl)-4-[3-(2-chloro-10-phenothiazinyl)propyl]piperazine
    • Perfenazina (INN-Spanish)
    • Perphenazinum (INN-Latin)
    • PERPHENAZINE (MART.)
    • PERPHENAZINE [MART.]
    • PERPHENAZINE (USP-RS)
    • PERPHENAZINE [USP-RS]
    • PERPHENAZINE (EP MONOGRAPH)
    • Perphenazine (USP:INN:BAN:JAN)
    • PERPHENAZINE [EP MONOGRAPH]
    • 1-Piperazineethanol, 4-[3-(2-chlorophenothiazin-10-yl)propyl]-
    • PERPHENAZINE (USP MONOGRAPH)
    • PERPHENAZINE [USP MONOGRAPH]
    • 2-Chloro-10-3-[1-(2-hydroxyethyl)-4-piperazinyl]propyl phenothiazine
    • SR-01000000137
    • 4-(3-(2-Chloro-10H-phenothiazin-10-yl)propyl)-1-piperazineethanol
    • Piperazineethanol, 4-[3-(2-chloro-10H-phenothiazin-10-yl)propyl]-
    • 2-(4-(3-(2-chloro-10H-phenothiazin-10-yl)propyl)-1-piperazinyl)ethanol
    • .gamma.-(4-(.beta.-Hydroxyethyl)piperazin-1-yl)propyl-2-chlorophenothiazine
    • .gamma.-[4-(.beta.-Hydroxyethyl)piperazin-1-yl]propyl-2-chlorophenothiazine
    • SCH-3940
    • Prestwick_536
    • 1',1-(2-Idrossietil)-4,3-(2-cloro-10-fenotiazil)propilpiperazina [Italian]
    • Etrafon (Salt/Mix)
    • 2-(4-{3-[2-Chloro(1,4,6,9-~2~H_4_)-10H-phenothiazin-10-yl]propyl}piperazin-1-yl)ethan-1-ol
    • PS16 - Perphenazine
    • Spectrum_001610
    • Perphenazine (Standard)
    • Opera_ID_1161
    • Prestwick0_000125
    • Prestwick1_000125
    • Prestwick2_000125
    • Prestwick3_000125
    • Spectrum2_001602
    • Spectrum3_000758
    • Spectrum4_000843
    • Spectrum5_001493
    • Lopac-P-6402
    • PERPHENAZINE [MI]
    • PERPHENAZINE [INN]
    • PERPHENAZINE [JAN]
    • P 6402
    • PERPHENAZINE [HSDB]
    • PERPHENAZINE [VANDF]
    • Lopac0_000930
    • Oprea1_603835
    • REGID_for_CID_4748
    • SCHEMBL42125
    • BSPBio_000170
    • BSPBio_002376
    • GTPL209
    • KBioGR_001445
    • KBioSS_002090
    • MLS001146929
    • MLS002548897
    • BIDD:GT0150
    • DivK1c_000880
    • PERPHENAZINE [WHO-DD]
    • SPECTRUM1503934
    • SPBio_001603
    • SPBio_002109
    • BPBio1_000188

  • Applications

    Perphenazine (CAS 58-39-9) is a pharmaceutical active ingredient in the phenothiazine class, used primarily as a typical antipsychotic in prescription medications for adult psychotic disorders.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 151.26
    methanol 143.53
    isopropanol 50.81
    water 1.44
    ethyl acetate 77.93
    n-propanol 211.11
    acetone 87.74
    n-butanol 184.03
    acetonitrile 22.65
    DMF 403.77
    toluene 21.99
    isobutanol 93.73
    1,4-dioxane 120.76
    methyl acetate 81.63
    THF 255.24
    2-butanone 152.89
    n-pentanol 90.54
    sec-butanol 64.97
    n-hexane 0.28
    ethylene glycol 69.97
    NMP 273.46
    cyclohexane 1.34
    DMSO 435.41
    n-butyl acetate 55.52
    n-octanol 11.69
    chloroform 374.52
    n-propyl acetate 87.41
    acetic acid 230.21
    dichloromethane 367.16
    cyclohexanone 255.33
    propylene glycol 77.7
    isopropyl acetate 38.83
    DMAc 550.19
    2-ethoxyethanol 442.54
    isopentanol 70.39
    n-heptane 0.72
    ethyl formate 201.09
    1,2-dichloroethane 163.44
    n-hexanol 31.82
    2-methoxyethanol 578.73
    isobutyl acetate 45.94
    tetrachloromethane 27.76
    n-pentyl acetate 68.89
    transcutol 295.34
    n-heptanol 24.13
    ethylbenzene 6.19
    MIBK 37.51
    2-propoxyethanol 200.3
    tert-butanol 18.56
    MTBE 10.24
    2-butoxyethanol 137.04
    propionic acid 141.44
    o-xylene 10.15
    formic acid 228.71
    diethyl ether 21.08
    m-xylene 11.41
    p-xylene 9.34
    chlorobenzene 51.64
    dimethyl carbonate 53.74
    n-octane 0.43
    formamide 278.73
    cyclopentanone 295.12
    2-pentanone 108.44
    anisole 26.88
    cyclopentyl methyl ether 63.3
    gamma-butyrolactone 334.62
    1-methoxy-2-propanol 233.89
    pyridine 171.99
    3-pentanone 65.19
    furfural 437.17
    n-dodecane 0.37
    diethylene glycol 207.85
    diisopropyl ether 3.41
    tert-amyl alcohol 23.39
    acetylacetone 93.89
    n-hexadecane 0.43
    acetophenone 61.77
    methyl propionate 92.08
    isopentyl acetate 40.57
    trichloroethylene 466.17
    n-nonanol 12.3
    cyclohexanol 76.3
    benzyl alcohol 100.33
    2-ethylhexanol 15.18
    isooctanol 18.55
    dipropyl ether 13.18
    1,2-dichlorobenzene 47.38
    ethyl lactate 74.45
    propylene carbonate 181.06
    n-methylformamide 311.21
    2-pentanol 33.55
    n-pentane 0.58
    1-propoxy-2-propanol 92.62
    1-methoxy-2-propyl acetate 79.91
    2-(2-methoxypropoxy) propanol 60.2
    mesitylene 4.93
    ε-caprolactone 244.74
    p-cymene 6.51
    epichlorohydrin 507.88
    1,1,1-trichloroethane 79.37
    2-aminoethanol 153.41
    morpholine-4-carbaldehyde 428.39
    sulfolane 372.01
    2,2,4-trimethylpentane 0.48
    2-methyltetrahydrofuran 104.12
    n-hexyl acetate 39.13
    isooctane 0.26
    2-(2-butoxyethoxy)ethanol 108.12
    sec-butyl acetate 36.78
    tert-butyl acetate 27.66
    decalin 0.69
    glycerin 165.36
    diglyme 248.14
    acrylic acid 143.54
    isopropyl myristate 10.26
    n-butyric acid 248.92
    acetyl acetate 47.45
    di(2-ethylhexyl) phthalate 26.86
    ethyl propionate 47.43
    nitromethane 285.12
    1,2-diethoxyethane 63.45
    benzonitrile 81.64
    trioctyl phosphate 16.35
    1-bromopropane 48.9
    gamma-valerolactone 666.75
    n-decanol 8.42
    triethyl phosphate 27.63
    4-methyl-2-pentanol 11.93
    propionitrile 41.77
    vinylene carbonate 216.59
    1,1,2-trichlorotrifluoroethane 543.82
    DMS 43.61
    cumene 4.46
    2-octanol 11.32
    2-hexanone 66.57
    octyl acetate 18.49
    limonene 8.34
    1,2-dimethoxyethane 249.11
    ethyl orthosilicate 24.25
    tributyl phosphate 20.76
    diacetone alcohol 63.51
    N,N-dimethylaniline 17.57
    acrylonitrile 70.35
    aniline 76.78
    1,3-propanediol 276.13
    bromobenzene 41.22
    dibromomethane 155.42
    1,1,2,2-tetrachloroethane 303.58
    2-methyl-cyclohexyl acetate 32.12
    tetrabutyl urea 26.95
    diisobutyl methanol 5.99
    2-phenylethanol 56.18
    styrene 9.38
    dioctyl adipate 27.33
    dimethyl sulfate 107.61
    ethyl butyrate 43.91
    methyl lactate 102.84
    butyl lactate 75.76
    diethyl carbonate 33.56
    propanediol butyl ether 84.95
    triethyl orthoformate 35.8
    p-tert-butyltoluene 5.3
    methyl 4-tert-butylbenzoate 46.47
    morpholine 271.76
    tert-butylamine 5.21
    n-dodecanol 5.76
    dimethoxymethane 198.06
    ethylene carbonate 185.54
    cyrene 123.72
    2-ethoxyethyl acetate 129.22
    2-ethylhexyl acetate 31.62
    1,2,4-trichlorobenzene 75.47
    4-methylpyridine 134.45
    dibutyl ether 10.11
    2,6-dimethyl-4-heptanol 5.99
    DEF 168.84
    dimethyl isosorbide 103.83
    tetrachloroethylene 186.36
    eugenol 68.07
    triacetin 65.01
    span 80 51.34
    1,4-butanediol 137.32
    1,1-dichloroethane 105.94
    2-methyl-1-pentanol 47.86
    methyl formate 246.19
    2-methyl-1-butanol 89.48
    n-decane 0.64
    butyronitrile 60.64
    3,7-dimethyl-1-octanol 10.07
    1-chlorooctane 4.56
    1-chlorotetradecane 1.7
    n-nonane 0.51
    undecane 0.47
    tert-butylcyclohexane 0.47
    cyclooctane 0.49
    cyclopentanol 105.28
    tetrahydropyran 105.88
    tert-amyl methyl ether 13.1
    2,5,8-trioxanonane 127.86
    1-hexene 2.68
    2-isopropoxyethanol 168.31
    2,2,2-trifluoroethanol 144.87
    methyl butyrate 98.71

    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