Troxerutin

Overview IFRA Request a quote

  • Identifiers

    CAS number
    7085-55-4

    Molecular formula
    C33H42O19

    SMILES
    C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)OCCO)C5=CC(=C(C=C5)OCCO)OCCO)O)O)O)O)O)O

    Safety labels

    Irritant
    Irritant

  • Odor profile

    Fragrance
    Odorless 74.42%
    Vanilla 29.84%
    Sweet 27.97%
    Milky 25.04%
    Creamy 20.16%
    Savory 19.95%
    Alcoholic 17.52%
    Dairy 16.97%
    Caramellic 16.19%
    Clean 15.33%

     

    Flavor
    Bitter 69.04%
    Odorless 38.64%
    Bland 35.07%
    Sweet-like 30.21%
    Very mild 23.99%
    Very slight 20.34%
    Eugenol 20.25%
    Cedarleaf 19.87%
    Parsley 19.85%
    Cauliflower 19.72%

     

    Odor impact est.
    Odorless

  • Properties

    XLogP3-AA
    -2.4

    pKa est.
    8.41 (weak base)

    Molecular weight
    742.7 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    6163°C

    Melting point expt.

    • 181 °C

    Flash point

    • 313.23 ˚C est.

  • Synonyms

    • Troxerutin
    • 7085-55-4
    • Troxerutine
    • Vitamin P4
    • Venoruton P4
    • Troxerutina
    • 3',4',7-Tris(hydroxyethyl)rutin
    • Troxerutinum
    • DTXSID4045929
    • Z 6000
    • 7Y4N11PXO8
    • Z-6000
    • NSC-758937
    • DTXCID2025929
    • 2-(3,4-Bis(2-hydroxyethoxy)phenyl)-3-((6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-5-hydroxy-7-(2-hydroxy ethoxy)-4H-1-benzopyran-4-one
    • 2-[3,4-bis(2-hydroxyethoxy)phenyl]-5-hydroxy-7-(2-hydroxyethoxy)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-4H-chromen-4-one
    • 2-(3,4-bis(2-hydroxyethoxy)phenyl)-5-hydroxy-7-(2-hydroxyethoxy)-3-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-((((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl)oxy)methyl)oxan-2-yl)oxy)-4H-chromen-4-one
    • 3',4',7-tris(O-(2-hydroxyethyl))rutin
    • RefChem:192282
    • C05CA04
    • 230-389-4
    • 4H-1-BENZOPYRAN-4-ONE, 2-(3,4-BIS(2-HYDROXYETHOXY)PHENYL)-3-((6-O-(6-DEOXY-ALPHA-L-MANNOPYRANOSYL)-BETA-D-GLUCOPYRANOSYL)OXY)-5-HYDROXY-7-(2-HYDROXYETHOXY)-
    • 3',4',7-trihydroxyethylrutin
    • Posorutin
    • Trihydroxyethylrutin
    • Factor P-zyma
    • Rufen-P4
    • Tris(hydroxyethyl)rutin
    • Tris(hydroxyethyl)rutoside
    • MFCD00893813
    • Troxerutin (INN)
    • 2-(3,4-bis(2-hydroxyethoxy)phenyl)-5-hydroxy-7-(2-hydroxyethoxy)-3-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-((((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one
    • Troxerutin (85%)
    • 2-[3,4-bis(2-hydroxyethoxy)phenyl]-5-hydroxy-7-(2-hydroxyethoxy)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
    • Pherarutin
    • Vastribil
    • Veinamitol
    • TROXERUTIN [INN]
    • Veno SL
    • Troksevazin
    • Troxarutin
    • Helveton
    • Venaroid
    • Veniten
    • Flebil
    • Ruven
    • Trioxyethylrutin
    • 3,5-Dihydroxy-3',4',7-tris(2-hydroxyethoxy)flavone 3-rutinoside
    • Pur-Rutin
    • Veinamitol Pulver
    • 4H-1-Benzopyran-4-one, 2-[3,4-bis(2-hydroxyethoxy)phenyl]-3-[[6-O-(6-deoxy-.alpha.-L-mannopyranosyl)-.beta.-D-glucopyranosyl]oxy]-5-hydroxy-7-(2-hydroxyethoxy)-
    • 55965-63-4
    • Troxarutin-ratiopharm
    • Trihydroxyethylrutoside
    • Troxerutine [INN-French]
    • Troxerutinum [INN-Latin]
    • Troxerutina [INN-Spanish]
    • UNII-7Y4N11PXO8
    • Troxerutin [INN:BAN:DCF]
    • Venoruton gel
    • CCRIS 1798
    • Trihydroxyethylrutoside [French]
    • Troxerutin CRS
    • TriHER
    • NCGC00095147-01
    • 4H-1-BENZOPYRAN-4-ONE, 2-(3,4-BIS(2-HYDROXYETHOXY)PHENYL)-3-((6-O-(6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL)-.BETA.-D-GLUCOPYRANOSYL)OXY)-5-HYDROXY-7-(2-HYDROXYETHOXY)-
    • EINECS 230-389-4
    • Troxerutin (Standard)
    • BRN 4778232
    • 7,3',4'-Tris(O-(2-hydroxyethyl)rutin
    • TROXERUTIN [MI]
    • Troxerutin(Oral/Injection)
    • TROXERUTIN [MART.]
    • TROXERUTIN [WHO-DD]
    • SCHEMBL142110
    • Tris-O-(2-hydroxyethyl)rutin
    • orb1310306
    • CHEMBL3182320
    • SCHEMBL29385785
    • SCHEMBL29397551
    • Tris-O-(b-hydroxyethyl)rutoside
    • UNII-808O347B5Y
    • HY-N0139R
    • TROXERUTIN [EP MONOGRAPH]
    • HY-N0139
    • Tox21_111450
    • EBC-11123
    • MSK158541
    • s2369
    • AKOS016339659
    • 808O347B5Y
    • CCG-270428
    • CS-8204
    • DB13124
    • KS-1394
    • NSC 758937
    • OT15980
    • SY105284
    • 3',4',7-Tri-O-(b-hydroxyethyl)rutoside
    • CAS-7085-55-4
    • 3?,4?,7-Tris[O-(2-hydroxyethyl)]rutin
    • D07180
    • 085T554
    • BRD-K73529671-001-02-9
    • BRD-K73529671-001-04-5
    • O-(.BETA.-HYDROXYETHYL)RUTOSIDE, (3',4',7)-TRI-
    • Troxerutin, European Pharmacopoeia (EP) Reference Standard
    • 2-[3,4-bis(2-hydroxyethoxy)phenyl]-5-hydroxy-7-(2-hydroxyethoxy)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-chromen-4-one
    • 2-[3,4-Bis(2-hydroxyethoxy)phenyl]-5-hydroxy-7-(2-hydroxyethoxy)-4-oxo-4H-1-benzopyran-3-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside
    • 2-[3,4-bis(2-Hydroxyethoxy)phenyl]-5-hydroxy-7-(2-hydroxyethoxy)-4-oxo-4H-chromen-3-yl 6-O-(6-deoxy-b-D-mannopyranosyl)-b-D-glucopyr anoside
    • 3-[6-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranoside]3,5-dihydroxy-3',4',7-tris(2-hydroxyethoxy)-Flavone
    • 3-[6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-delta-glucopyranoside]3,5-dihydroxy-3',4',7-tris(2-hydroxyethoxy)-Flavone
    • Flavone, 3,5-dihydroxy-3',4',7-tris(2-hydroxyethoxy)-, 3-(6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside)
    • 7085-55-4

  • Applications

    Troxerutin (CAS 7085-55-4) is used as an active pharmaceutical ingredient in venotonic and microcirculation-support formulations, where it is included to influence vascular stability. It is also employed in cosmetics and personal care as an antioxidant additive in skin care formulations. In analytical chemistry, it serves as a reference standard for the quantification of flavonoids in plant extracts and pharmaceutical products. Additionally, Troxerutin is studied as an antioxidant stabilizer in polymer and coating formulations to improve oxidative stability.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 3.05
    methanol 6.56
    isopropanol 1.34
    water 0.28
    ethyl acetate 0.3
    n-propanol 2.27
    acetone 0.55
    n-butanol 1.27
    acetonitrile 0.25
    DMF 11.3
    toluene 0.07
    isobutanol 0.7
    1,4-dioxane 4.82
    methyl acetate 0.76
    THF 4.23
    2-butanone 1.02
    n-pentanol 0.69
    sec-butanol 1.26
    n-hexane 0.01
    ethylene glycol 7.03
    NMP 15.63
    cyclohexane 0.02
    DMSO 15.21
    n-butyl acetate 0.16
    n-octanol 0.41
    chloroform 0.26
    n-propyl acetate 0.2
    acetic acid 6.64
    dichloromethane 0.44
    cyclohexanone 1.46
    propylene glycol 7.6
    isopropyl acetate 0.14
    DMAc 12.37
    2-ethoxyethanol 4.91
    isopentanol 0.45
    n-heptane 0.02
    ethyl formate 0.76
    1,2-dichloroethane 0.34
    n-hexanol 0.28
    2-methoxyethanol 13.4
    isobutyl acetate 0.07
    tetrachloromethane 0.05
    n-pentyl acetate 0.41
    transcutol 6.25
    n-heptanol 0.46
    ethylbenzene 0.03
    MIBK 0.15
    2-propoxyethanol 2.71
    tert-butanol 0.43
    MTBE 0.18
    2-butoxyethanol 2.64
    propionic acid 2.49
    o-xylene 0.05
    formic acid 15.3
    diethyl ether 0.39
    m-xylene 0.03
    p-xylene 0.03
    chlorobenzene 0.04
    dimethyl carbonate 0.89
    n-octane 0.01
    formamide 11.31
    cyclopentanone 2.38
    2-pentanone 0.46
    anisole 0.12
    cyclopentyl methyl ether 0.57
    gamma-butyrolactone 3.45
    1-methoxy-2-propanol 6.37
    pyridine 1.41
    3-pentanone 0.4
    furfural 3.42
    n-dodecane 0.01
    diethylene glycol 5.07
    diisopropyl ether 0.03
    tert-amyl alcohol 0.54
    acetylacetone 0.51
    n-hexadecane 0.01
    acetophenone 0.23
    methyl propionate 0.8
    isopentyl acetate 0.11
    trichloroethylene 0.51
    n-nonanol 0.4
    cyclohexanol 0.78
    benzyl alcohol 0.48
    2-ethylhexanol 0.11
    isooctanol 0.23
    dipropyl ether 0.19
    1,2-dichlorobenzene 0.04
    ethyl lactate 0.64
    propylene carbonate 0.87
    n-methylformamide 6.59
    2-pentanol 0.46
    n-pentane 0.02
    1-propoxy-2-propanol 1.44
    1-methoxy-2-propyl acetate 0.52
    2-(2-methoxypropoxy) propanol 1.6
    mesitylene 0.02
    ε-caprolactone 1.84
    p-cymene 0.02
    epichlorohydrin 3.06
    1,1,1-trichloroethane 0.06
    2-aminoethanol 6.65
    morpholine-4-carbaldehyde 14.4
    sulfolane 8.64
    2,2,4-trimethylpentane 0.01
    2-methyltetrahydrofuran 1.23
    n-hexyl acetate 0.43
    isooctane 0.0
    2-(2-butoxyethoxy)ethanol 2.89
    sec-butyl acetate 0.1
    tert-butyl acetate 0.11
    decalin 0.0
    glycerin 17.03
    diglyme 4.71
    acrylic acid 4.17
    isopropyl myristate 0.1
    n-butyric acid 1.4
    acetyl acetate 0.18
    di(2-ethylhexyl) phthalate 0.2
    ethyl propionate 0.18
    nitromethane 4.79
    1,2-diethoxyethane 0.66
    benzonitrile 0.15
    trioctyl phosphate 0.19
    1-bromopropane 0.13
    gamma-valerolactone 9.36
    n-decanol 0.24
    triethyl phosphate 0.13
    4-methyl-2-pentanol 0.11
    propionitrile 0.3
    vinylene carbonate 0.99
    1,1,2-trichlorotrifluoroethane 7.82
    DMS 0.4
    cumene 0.01
    2-octanol 0.24
    2-hexanone 0.27
    octyl acetate 0.25
    limonene 0.04
    1,2-dimethoxyethane 3.39
    ethyl orthosilicate 0.12
    tributyl phosphate 0.15
    diacetone alcohol 0.84
    N,N-dimethylaniline 0.11
    acrylonitrile 0.6
    aniline 0.39
    1,3-propanediol 6.31
    bromobenzene 0.02
    dibromomethane 0.17
    1,1,2,2-tetrachloroethane 0.52
    2-methyl-cyclohexyl acetate 0.12
    tetrabutyl urea 0.34
    diisobutyl methanol 0.04
    2-phenylethanol 0.24
    styrene 0.03
    dioctyl adipate 0.27
    dimethyl sulfate 2.28
    ethyl butyrate 0.15
    methyl lactate 3.09
    butyl lactate 0.9
    diethyl carbonate 0.1
    propanediol butyl ether 3.31
    triethyl orthoformate 0.22
    p-tert-butyltoluene 0.02
    methyl 4-tert-butylbenzoate 0.52
    morpholine 7.78
    tert-butylamine 0.12
    n-dodecanol 0.14
    dimethoxymethane 3.97
    ethylene carbonate 0.7
    cyrene 2.6
    2-ethoxyethyl acetate 1.07
    2-ethylhexyl acetate 0.09
    1,2,4-trichlorobenzene 0.08
    4-methylpyridine 0.52
    dibutyl ether 0.17
    2,6-dimethyl-4-heptanol 0.04
    DEF 1.76
    dimethyl isosorbide 1.52
    tetrachloroethylene 0.38
    eugenol 0.72
    triacetin 0.76
    span 80 1.86
    1,4-butanediol 2.16
    1,1-dichloroethane 0.12
    2-methyl-1-pentanol 0.3
    methyl formate 4.15
    2-methyl-1-butanol 0.66
    n-decane 0.02
    butyronitrile 0.23
    3,7-dimethyl-1-octanol 0.14
    1-chlorooctane 0.07
    1-chlorotetradecane 0.02
    n-nonane 0.01
    undecane 0.01
    tert-butylcyclohexane 0.0
    cyclooctane 0.01
    cyclopentanol 1.43
    tetrahydropyran 1.22
    tert-amyl methyl ether 0.23
    2,5,8-trioxanonane 3.06
    1-hexene 0.03
    2-isopropoxyethanol 1.64
    2,2,2-trifluoroethanol 3.51
    methyl butyrate 0.32

    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