1,2-Dichloro-1,1,3,3,3-pentafluoropropane

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  • Identifiers

    CAS number
    431-86-7

    Molecular formula
    C3HCl2F5

    SMILES
    C(C(F)(F)F)(C(F)(F)Cl)Cl

  • Odor profile

    Fragrance
    Odorless 45.97%
    Woody 26.48%
    Sweet 25.02%
    Fishy 23.84%
    Cooling 23.03%
    Balsamic 21.0%
    Animal 17.94%
    Dry 17.05%
    Fresh 16.87%
    Oily 16.85%

     

    Flavor
    Odorless 32.44%
    Sulfurous 22.05%
    Bland 20.23%
    Mild 18.57%
    Sulfury 18.16%
    Bloody 17.91%
    Glue 17.75%
    Bouillon 17.62%
    Sweet-like 17.58%
    Skunky 17.25%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    3.4

    pKa est.
    6.64 (neutral)

    Molecular weight
    202.93 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra fast

    Boiling point est.
    48°C

    Flash point

    • 12.66 ˚C est.

  • Synonyms

    • 1,2-DICHLORO-1,1,3,3,3-PENTAFLUOROPROPANE
    • 431-86-7
    • Hcfc 225da
    • HCFC-225da
    • 141563-84-0
    • Propane, 1,2-dichloro-1,1,3,3,3-pentafluoro-
    • FAY2SA21WQ
    • UNII-FAY2SA21WQ
    • DTXSID0042030
    • 2,3-dichloro-1,1,1,3,3-pentafluoropropane
    • ASAHIKLIN AK-225
    • SCHEMBL1990356
    • DTXCID8022030
    • 2H-1,2-Dichloropentafluoropropane
    • MFCD00054727
    • AKOS007930295
    • FD86074
    • NS00126540
    • 1,1,1,3,3-pentafluoro-2,-3-dichloropropane
    • A826204
    • Q27893566
    • PROPANE,1,2-DICHLORO-1,1,3,3,3-PENTAFLUORO-
    • 1,2-bis(chloranyl)-1,1,3,3,3-pentakis(fluoranyl)propane

  • Applications

    1,2-Dichloro-1,1,3,3,3-pentafluoropropane is primarily used as an intermediate in the synthesis of fluorinated polymers and other organofluorine chemicals; it may also function as a specialty solvent or processing aid in coatings, inks, and adhesives in industrial manufacturing; it is viewed as a building block for flame-retardant formulations containing fluorine and related materials; and it is used as a research and development reagent in organofluorine chemistry.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 571.77
    methanol 1205.14
    isopropanol 454.97
    water 200.25
    ethyl acetate 279.57
    n-propanol 387.79
    acetone 897.52
    n-butanol 297.59
    acetonitrile 615.38
    DMF 2273.7
    toluene 101.45
    isobutanol 306.68
    1,4-dioxane 539.62
    methyl acetate 340.11
    THF 1024.39
    2-butanone 494.66
    n-pentanol 261.01
    sec-butanol 314.11
    n-hexane 68.37
    ethylene glycol 341.87
    NMP 1502.13
    cyclohexane 53.22
    DMSO 2491.22
    n-butyl acetate 151.79
    n-octanol 106.49
    chloroform 167.36
    n-propyl acetate 256.03
    acetic acid 316.23
    dichloromethane 233.91
    cyclohexanone 379.17
    propylene glycol 266.75
    isopropyl acetate 225.08
    DMAc 1873.28
    2-ethoxyethanol 621.18
    isopentanol 256.23
    n-heptane 48.07
    ethyl formate 292.14
    1,2-dichloroethane 242.46
    n-hexanol 154.0
    2-methoxyethanol 959.56
    isobutyl acetate 138.28
    tetrachloromethane 46.89
    n-pentyl acetate 100.91
    transcutol 602.96
    n-heptanol 85.55
    ethylbenzene 90.26
    MIBK 292.99
    2-propoxyethanol 424.92
    tert-butanol 460.19
    MTBE 320.53
    2-butoxyethanol 203.12
    propionic acid 217.8
    o-xylene 117.44
    formic acid 373.26
    diethyl ether 421.47
    m-xylene 102.23
    p-xylene 97.21
    chlorobenzene 54.53
    dimethyl carbonate 311.79
    n-octane 20.84
    formamide 739.43
    cyclopentanone 570.27
    2-pentanone 420.66
    anisole 249.16
    cyclopentyl methyl ether 427.53
    gamma-butyrolactone 552.9
    1-methoxy-2-propanol 737.24
    pyridine 290.64
    3-pentanone 358.15
    furfural 471.89
    n-dodecane 17.95
    diethylene glycol 433.79
    diisopropyl ether 150.78
    tert-amyl alcohol 335.4
    acetylacetone 420.29
    n-hexadecane 18.46
    acetophenone 249.07
    methyl propionate 354.05
    isopentyl acetate 115.69
    trichloroethylene 212.67
    n-nonanol 103.3
    cyclohexanol 205.5
    benzyl alcohol 195.98
    2-ethylhexanol 96.68
    isooctanol 69.91
    dipropyl ether 228.24
    1,2-dichlorobenzene 56.35
    ethyl lactate 217.56
    propylene carbonate 265.72
    n-methylformamide 957.91
    2-pentanol 238.71
    n-pentane 83.89
    1-propoxy-2-propanol 290.05
    1-methoxy-2-propyl acetate 241.65
    2-(2-methoxypropoxy) propanol 272.3
    mesitylene 80.84
    ε-caprolactone 294.53
    p-cymene 62.08
    epichlorohydrin 515.04
    1,1,1-trichloroethane 125.67
    2-aminoethanol 412.83
    morpholine-4-carbaldehyde 1081.13
    sulfolane 787.34
    2,2,4-trimethylpentane 31.19
    2-methyltetrahydrofuran 485.3
    n-hexyl acetate 130.58
    isooctane 24.92
    2-(2-butoxyethoxy)ethanol 299.87
    sec-butyl acetate 159.65
    tert-butyl acetate 233.3
    decalin 31.67
    glycerin 375.27
    diglyme 525.83
    acrylic acid 217.43
    isopropyl myristate 83.16
    n-butyric acid 206.64
    acetyl acetate 157.52
    di(2-ethylhexyl) phthalate 74.76
    ethyl propionate 265.67
    nitromethane 826.93
    1,2-diethoxyethane 254.8
    benzonitrile 147.58
    trioctyl phosphate 67.76
    1-bromopropane 180.47
    gamma-valerolactone 717.53
    n-decanol 86.55
    triethyl phosphate 105.49
    4-methyl-2-pentanol 156.17
    propionitrile 347.82
    vinylene carbonate 212.33
    1,1,2-trichlorotrifluoroethane 358.15
    DMS 146.31
    cumene 78.71
    2-octanol 67.56
    2-hexanone 330.8
    octyl acetate 98.52
    limonene 87.28
    1,2-dimethoxyethane 1041.1
    ethyl orthosilicate 100.97
    tributyl phosphate 80.23
    diacetone alcohol 364.47
    N,N-dimethylaniline 291.33
    acrylonitrile 389.3
    aniline 162.98
    1,3-propanediol 362.07
    bromobenzene 43.05
    dibromomethane 175.7
    1,1,2,2-tetrachloroethane 211.49
    2-methyl-cyclohexyl acetate 120.89
    tetrabutyl urea 168.36
    diisobutyl methanol 79.85
    2-phenylethanol 135.93
    styrene 91.22
    dioctyl adipate 118.67
    dimethyl sulfate 464.02
    ethyl butyrate 181.51
    methyl lactate 347.84
    butyl lactate 119.37
    diethyl carbonate 124.41
    propanediol butyl ether 211.33
    triethyl orthoformate 136.4
    p-tert-butyltoluene 60.23
    methyl 4-tert-butylbenzoate 179.51
    morpholine 694.27
    tert-butylamine 329.6
    n-dodecanol 73.14
    dimethoxymethane 1239.66
    ethylene carbonate 205.82
    cyrene 366.37
    2-ethoxyethyl acetate 138.6
    2-ethylhexyl acetate 92.1
    1,2,4-trichlorobenzene 72.14
    4-methylpyridine 311.45
    dibutyl ether 134.69
    2,6-dimethyl-4-heptanol 79.85
    DEF 664.78
    dimethyl isosorbide 465.63
    tetrachloroethylene 131.57
    eugenol 192.8
    triacetin 153.52
    span 80 161.33
    1,4-butanediol 231.09
    1,1-dichloroethane 176.73
    2-methyl-1-pentanol 191.59
    methyl formate 683.24
    2-methyl-1-butanol 244.02
    n-decane 26.18
    butyronitrile 285.16
    3,7-dimethyl-1-octanol 99.66
    1-chlorooctane 58.85
    1-chlorotetradecane 33.68
    n-nonane 25.51
    undecane 20.94
    tert-butylcyclohexane 30.25
    cyclooctane 27.76
    cyclopentanol 295.12
    tetrahydropyran 368.45
    tert-amyl methyl ether 296.78
    2,5,8-trioxanonane 453.7
    1-hexene 145.85
    2-isopropoxyethanol 398.78
    2,2,2-trifluoroethanol 228.5
    methyl butyrate 318.08

    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