Trifluoperazine

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  • Identifiers

    CAS number
    117-89-5

    Molecular formula
    C21H24F3N3S

    SMILES
    CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F

  • Odor profile

    Odorless 52.41%
    Fishy 33.49%
    Meaty 31.94%
    Savory 28.44%
    Animal 28.39%
    Cooked 25.48%
    Cheesy 23.99%
    Roasted 23.68%
    Cooling 22.56%
    Ripe 22.35%

    Scent© AI

  • Properties

    XLogP3-AA
    5.0

    Molecular weight
    407.5 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Melting point expt.

    • Cream-colored, fine powder from absolute alcohol; MP: 242-243 °C; pH of 5% aq soln= 2.2, Hygroscopic /Dihydrochloride/
    • MP: 193-194 °C; crystals from alcohol /Dimaleate/
    • MP: 173-175 °C /Sulfoxide dihydrochloride trihydrate/

    Boiling point

    • 202-210 °C @ 0.6 mm Hg

    Flash point est.
    226.92 ˚C

    Solubility expt.

    • 12.2 mg/L (at 24 °C)
    • Freely sol in water /Dihydrochloride/
    • FREELY SOL IN WATER; SOL IN ALCOHOL; SPARINGLY SOL IN CHLOROFORM; INSOL IN ETHER & BENZENE /HYDROCHLORIDE/
    • In water, 12.2 mg/l @ 25 °C
    • 8.76e-03 g/L

  • Synonyms

    • trifluoperazine
    • 117-89-5
    • Trifluperazine
    • Trifluoroperazine
    • Trifluoperazin
    • Trifluoperazina
    • Flurazine
    • Triflurin
    • Triperazine
    • Trifluoromethylperazine
    • Trifluoperazinum
    • Trifluroperizine
    • Apo-Trifluoperazine
    • Eskazine
    • RP 7623
    • 10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine
    • TFP
    • Fluoperazine
    • Trifluoromethyl-10-(3'-(1-methyl-4-piperazinyl)propyl)phenothiazine
    • Trifluoperazinum [INN-Latin]
    • 10H-Phenothiazine, 10-[3-(4-methyl-1-piperazinyl)propyl]-2-(trifluoromethyl)-
    • Trifluoperazina [INN-Spanish]
    • CCRIS 6994
    • HSDB 3195
    • 10-(3-(4-methylpiperazin-1-yl)propyl)-2-(trifluoromethyl)-10H-phenothiazine
    • EINECS 204-219-4
    • NSC 17474
    • NSC 46061
    • NSC-17474
    • 10-(3-(4-Methyl-1-piperazinyl)propyl)-2-(trifluoromethyl)phenothiazine
    • 10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)-10H-phenothiazine
    • Calmazine
    • UNII-214IZI85K3
    • CHEBI:45951
    • Trifluoperazine (INN)
    • 10-(gamma-(N'-Methylpiperazino)propyl)-2-trifluoromethylphenothiazine
    • 214IZI85K3
    • 10-[3-(4-Methyl-1-piperazinyl)propyl]-2-(trifluoromethyl)-10H-phenothiazine
    • 10H-Phenothiazine, 10-(3-(4-methyl-1-piperazinyl)propyl)-2-(trifluoromethyl)-
    • NSC-46061
    • RP-7623
    • 2-Trifluoromethyl-10-(3'-(1-methyl-4-piperazinyl)propyl)phenothiazine
    • Phenothiazine, 10-(3-(4-methyl-1-piperazinyl)propyl)-2-(trifluoromethyl)-
    • 10-[3-(4-METHYL-PIPERAZIN-1-YL)-PROPYL]-2-TRIFLUOROMETHYL-10H-PHENOTHIAZINE
    • SKF 5019
    • Stellazine
    • NSC17474
    • 10-(3-(4-methyl-1-piperazinyl)propyl)-2-(trifluoromethyl)-10H-phenothiazine
    • Trifluoperazina [Italian]
    • TRIFLUOPERAZINE [INN]
    • Trifluoperazinum (INN-Latin)
    • Trifluoperazina (INN-Spanish)
    • Trifluoperazine [INN:BAN]
    • 81498-90-0
    • C21H24F3N3S
    • MLS001146870
    • MLS002702821
    • 2-Trifluoromethyl-10-[3'-(1-methyl-4-piperazinyl)propyl]phenothiazine
    • 10H-Phenothiazine,10-[3-[4-(methyl-d3)-1-piperazinyl]propyl]-2-(trifluoromethyl)-
    • SMR001566649
    • 1432064-02-2
    • 10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine dihydrochloride
    • CAS-440-17-5
    • Apo-trifluoperazine (TN)
    • Stelazine (*Dihydrochloride*)
    • 10-(3-(4-methylpiperazin-1-yl)propyl)-2-(trifluoromethyl)phenothiazine
    • Phenothiazine, 10-[3-(4-methyl-1-piperazinyl)propyl]-2-(trifluoromethyl)-
    • 10-(3-(4-METHYL-PIPERAZIN-1-YL)-PROPYL)-2-TRIFLUOROMETHYL-10H-PHENOTHIAZINE
    • NCI17474
    • Synklor (Salt/Mix)
    • Stelazine (Salt/Mix)
    • Triftazin (Salt/Mix)
    • Spectrum_000668
    • Terfluzine (Salt/Mix)
    • Triftazine (Salt/Mix)
    • Jatroneural (Salt/Mix)
    • Fluoperazine (Salt/Mix)
    • Triphthazine (Salt/Mix)
    • Prestwick0_000313
    • Prestwick1_000313
    • Prestwick2_000313
    • Prestwick3_000313
    • Spectrum2_000828
    • Spectrum3_001374
    • Spectrum4_000368
    • Spectrum5_001553
    • Lopac-T-8516
    • Biomol-NT_000060
    • CHEMBL422
    • cid_5566
    • NCIStruc1_001127
    • NCIStruc2_001093
    • TRIFLUOPERAZINE [MI]
    • BIDD:PXR0132
    • Lopac0_001232
    • SCHEMBL24866
    • BSPBio_000306
    • BSPBio_001190
    • BSPBio_002928
    • GTPL214
    • KBioGR_000530
    • KBioGR_000835
    • KBioGR_002431
    • KBioSS_000530
    • KBioSS_001148
    • KBioSS_002437
    • MLS006011857
    • DivK1c_000843
    • TRIFLUOPERAZINE [HSDB]
    • SPBio_000755
    • SPBio_002525
    • TRIFLUOPERAZINE [VANDF]
    • BPBio1_000338
    • BPBio1_001345
    • 2-TRIFLUOROMETHYL-10-
    • Trifluoperazine-d3 Hydrochloride
    • DTXSID1046928
    • TRIFLUOPERAZINE [WHO-DD]
    • BDBM79181
    • cid_2913535
    • KBio1_000843
    • KBio2_000530
    • KBio2_001148
    • KBio2_002431
    • KBio2_003098
    • KBio2_003716
    • KBio2_004999
    • KBio2_005666

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 182.45
    methanol 207.35
    isopropanol 84.1
    water 0.19
    ethyl acetate 145.65
    n-propanol 142.13
    acetone 195.31
    n-butanol 110.02
    acetonitrile 88.95
    DMF 342.7
    toluene 48.32
    isobutanol 76.02
    1,4-dioxane 138.26
    methyl acetate 160.73
    THF 225.74
    2-butanone 178.93
    n-pentanol 62.97
    sec-butanol 77.57
    n-hexane 0.89
    ethylene glycol 41.84
    NMP 218.04
    cyclohexane 2.24
    DMSO 379.32
    n-butyl acetate 68.29
    n-octanol 13.44
    chloroform 748.83
    n-propyl acetate 90.22
    acetic acid 325.35
    dichloromethane 665.67
    cyclohexanone 184.51
    propylene glycol 54.1
    isopropyl acetate 76.87
    DMAc 355.18
    2-ethoxyethanol 204.11
    isopentanol 67.96
    n-heptane 1.01
    ethyl formate 159.96
    1,2-dichloroethane 292.31
    n-hexanol 36.57
    2-methoxyethanol 346.61
    isobutyl acetate 41.51
    tetrachloromethane 53.49
    n-pentyl acetate 64.5
    transcutol 358.18
    n-heptanol 24.63
    ethylbenzene 15.26
    MIBK 57.48
    2-propoxyethanol 139.91
    tert-butanol 48.67
    MTBE 31.3
    2-butoxyethanol 93.29
    propionic acid 138.89
    o-xylene 24.9
    formic acid 204.26
    diethyl ether 61.44
    m-xylene 27.32
    p-xylene 18.64
    chlorobenzene 73.96
    dimethyl carbonate 96.46
    n-octane 0.6
    formamide 327.21
    cyclopentanone 211.88
    2-pentanone 131.04
    anisole 46.95
    cyclopentyl methyl ether 64.87
    gamma-butyrolactone 259.49
    1-methoxy-2-propanol 177.63
    pyridine 195.22
    3-pentanone 95.66
    furfural 293.76
    n-dodecane 0.5
    diethylene glycol 148.83
    diisopropyl ether 10.84
    tert-amyl alcohol 45.97
    acetylacetone 159.78
    n-hexadecane 0.58
    acetophenone 73.19
    methyl propionate 132.18
    isopentyl acetate 53.37
    trichloroethylene 714.5
    n-nonanol 14.52
    cyclohexanol 57.71
    benzyl alcohol 81.35
    2-ethylhexanol 18.01
    isooctanol 20.12
    dipropyl ether 18.71
    1,2-dichlorobenzene 69.15
    ethyl lactate 70.01
    propylene carbonate 160.6
    n-methylformamide 267.08
    2-pentanol 44.44
    n-pentane 2.06
    1-propoxy-2-propanol 77.19
    1-methoxy-2-propyl acetate 106.79
    2-(2-methoxypropoxy) propanol 77.75
    mesitylene 12.45
    ε-caprolactone 179.2
    p-cymene 11.16
    epichlorohydrin 419.99
    1,1,1-trichloroethane 167.39
    2-aminoethanol 101.7
    morpholine-4-carbaldehyde 312.59
    sulfolane 248.28
    2,2,4-trimethylpentane 1.15
    2-methyltetrahydrofuran 112.29
    n-hexyl acetate 48.72
    isooctane 0.79
    2-(2-butoxyethoxy)ethanol 113.48
    sec-butyl acetate 51.38
    tert-butyl acetate 57.54
    decalin 1.12
    glycerin 95.51
    diglyme 233.13
    acrylic acid 151.35
    isopropyl myristate 15.87
    n-butyric acid 186.37
    acetyl acetate 111.06
    di(2-ethylhexyl) phthalate 31.95
    ethyl propionate 68.53
    nitromethane 454.98
    1,2-diethoxyethane 88.65
    benzonitrile 79.49
    trioctyl phosphate 19.23
    1-bromopropane 99.21
    gamma-valerolactone 421.36
    n-decanol 10.27
    triethyl phosphate 33.62
    4-methyl-2-pentanol 21.39
    propionitrile 82.65
    vinylene carbonate 199.41
    1,1,2-trichlorotrifluoroethane 424.29
    DMS 80.59
    cumene 9.63
    2-octanol 14.34
    2-hexanone 65.66
    octyl acetate 25.18
    limonene 12.71
    1,2-dimethoxyethane 200.3
    ethyl orthosilicate 29.24
    tributyl phosphate 24.81
    diacetone alcohol 85.23
    N,N-dimethylaniline 27.11
    acrylonitrile 127.18
    aniline 89.3
    1,3-propanediol 156.19
    bromobenzene 67.15
    dibromomethane 342.48
    1,1,2,2-tetrachloroethane 463.3
    2-methyl-cyclohexyl acetate 39.96
    tetrabutyl urea 31.8
    diisobutyl methanol 10.35
    2-phenylethanol 61.71
    styrene 20.4
    dioctyl adipate 35.73
    dimethyl sulfate 161.92
    ethyl butyrate 54.2
    methyl lactate 110.86
    butyl lactate 68.44
    diethyl carbonate 47.5
    propanediol butyl ether 73.82
    triethyl orthoformate 42.0
    p-tert-butyltoluene 9.36
    methyl 4-tert-butylbenzoate 62.9
    morpholine 217.92
    tert-butylamine 18.55
    n-dodecanol 7.28
    dimethoxymethane 220.83
    ethylene carbonate 152.21
    cyrene 96.69
    2-ethoxyethyl acetate 136.51
    2-ethylhexyl acetate 41.27
    1,2,4-trichlorobenzene 101.78
    4-methylpyridine 161.47
    dibutyl ether 13.09
    2,6-dimethyl-4-heptanol 10.35
    DEF 162.38
    dimethyl isosorbide 123.06
    tetrachloroethylene 289.58
    eugenol 74.5
    triacetin 88.95
    span 80 56.6
    1,4-butanediol 62.73
    1,1-dichloroethane 230.63
    2-methyl-1-pentanol 45.35
    methyl formate 210.09
    2-methyl-1-butanol 73.37
    n-decane 0.78
    butyronitrile 82.93
    3,7-dimethyl-1-octanol 14.47
    1-chlorooctane 6.04
    1-chlorotetradecane 2.44
    n-nonane 0.63
    undecane 0.61
    tert-butylcyclohexane 0.91
    cyclooctane 0.78
    cyclopentanol 69.0
    tetrahydropyran 97.97
    tert-amyl methyl ether 29.37
    2,5,8-trioxanonane 144.76
    1-hexene 7.39
    2-isopropoxyethanol 102.88
    2,2,2-trifluoroethanol 151.33
    methyl butyrate 99.32

    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