2,5-Bis(hydroxymethyl)oxolane-2,3,4-triol
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Identifiers
Molecular formula
C6H12O6SMILES
C(C1C(C(C(O1)(CO)O)O)O)O
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Odor profile
Fragrance Odorless 64.16% Sweet 61.07% Caramellic 26.75% Woody 21.08% Alcoholic 20.41% Clean 18.1% Bitter 16.14% Creamy 15.43% Vanilla 15.29% Milky 15.18% Flavor Sweet 85.89% Odorless 62.41% Bitter 50.97% Sweet-like 32.68% Alcoholic 24.31% Very slight 23.26% Cauliflower 22.43% Vanilla 20.87% Soup 20.85% Alkaline 20.48% Odor impact est.
Low -
Properties
XLogP3-AA
-2.3pKa est.
5.62 (weak acid)Molecular weight
180.16 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Ultra slowBoiling point est.
777°CFlash point
- 224.51 ˚C est.
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Synonyms
- 2,5-bis(hydroxymethyl)oxolane-2,3,4-triol
- b-D-Psicofuranose
- beta-D-Fructose
- D-FRUCTOSE-6 6-D2
- a-d-fructofuranose
- ?-D-Fructose
- SCHEMBL4967453
- CHEBI:193745
- RFSUNEUAIZKAJO-UHFFFAOYSA-N
- MFCD20488856
- LS-13188
- SY356361
- NS00124951
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Applications
2,5-Bis(hydroxymethyl)oxolane-2,3,4-triol is a highly functional polyol used as a building block for polyurethanes and polyesters, providing multiple hydroxyl groups for crosslinking and chain extension. It is commonly evaluated as a multifunctional monomer or crosslinking agent for bio-based resin systems in coatings and inks, improving film properties and adhesion. It can also function as a crosslinker or reactive diluent in coatings and adhesives formulations. In cosmetics and personal care, it may be used as a humectant or thickener due to the hygroscopic hydroxyl groups. In household products, it may serve as a humectant and viscosity modifier to help stabilize formulations. These applications are formulation- and regulation-dependent and may be exploratory or restricted by local regulations.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 41.28 methanol 238.33 isopropanol 15.01 water 2021.9 ethyl acetate 6.1 n-propanol 14.53 acetone 10.87 n-butanol 11.82 acetonitrile 5.4 DMF 566.63 toluene 1.07 isobutanol 7.49 1,4-dioxane 34.07 methyl acetate 3.81 THF 21.06 2-butanone 6.42 n-pentanol 8.57 sec-butanol 12.57 n-hexane 0.49 ethylene glycol 425.61 NMP 238.99 cyclohexane 2.07 DMSO 1630.3 n-butyl acetate 2.45 n-octanol 5.55 chloroform 2.64 n-propyl acetate 2.35 acetic acid 32.81 dichloromethane 5.53 cyclohexanone 13.45 propylene glycol 120.45 isopropyl acetate 4.15 DMAc 224.66 2-ethoxyethanol 91.22 isopentanol 7.35 n-heptane 2.06 ethyl formate 6.44 1,2-dichloroethane 6.16 n-hexanol 6.87 2-methoxyethanol 234.03 isobutyl acetate 1.01 tetrachloromethane 1.53 n-pentyl acetate 2.7 transcutol 46.42 n-heptanol 7.35 ethylbenzene 0.99 MIBK 4.47 2-propoxyethanol 41.57 tert-butanol 12.69 MTBE 4.15 2-butoxyethanol 28.19 propionic acid 14.1 o-xylene 2.44 formic acid 643.31 diethyl ether 5.65 m-xylene 1.88 p-xylene 1.07 chlorobenzene 0.88 dimethyl carbonate 15.54 n-octane 1.02 formamide 501.67 cyclopentanone 16.22 2-pentanone 6.8 anisole 3.45 cyclopentyl methyl ether 10.08 gamma-butyrolactone 24.99 1-methoxy-2-propanol 100.53 pyridine 6.83 3-pentanone 6.55 furfural 38.14 n-dodecane 0.57 diethylene glycol 139.6 diisopropyl ether 2.05 tert-amyl alcohol 11.36 acetylacetone 14.39 n-hexadecane 0.62 acetophenone 5.0 methyl propionate 11.48 isopentyl acetate 1.79 trichloroethylene 5.51 n-nonanol 5.07 cyclohexanol 13.86 benzyl alcohol 8.69 2-ethylhexanol 3.68 isooctanol 5.03 dipropyl ether 5.42 1,2-dichlorobenzene 1.48 ethyl lactate 12.41 propylene carbonate 8.59 n-methylformamide 173.27 2-pentanol 7.56 n-pentane 0.98 1-propoxy-2-propanol 21.28 1-methoxy-2-propyl acetate 9.8 2-(2-methoxypropoxy) propanol 19.6 mesitylene 1.97 ε-caprolactone 13.43 p-cymene 1.83 epichlorohydrin 19.92 1,1,1-trichloroethane 1.25 2-aminoethanol 195.32 morpholine-4-carbaldehyde 196.74 sulfolane 128.78 2,2,4-trimethylpentane 0.54 2-methyltetrahydrofuran 9.16 n-hexyl acetate 3.29 isooctane 0.36 2-(2-butoxyethoxy)ethanol 28.0 sec-butyl acetate 1.6 tert-butyl acetate 4.52 decalin 0.65 glycerin 394.08 diglyme 57.26 acrylic acid 24.93 isopropyl myristate 1.63 n-butyric acid 11.58 acetyl acetate 3.96 di(2-ethylhexyl) phthalate 3.02 ethyl propionate 3.57 nitromethane 60.62 1,2-diethoxyethane 6.82 benzonitrile 3.05 trioctyl phosphate 3.01 1-bromopropane 1.77 gamma-valerolactone 57.35 n-decanol 3.84 triethyl phosphate 3.54 4-methyl-2-pentanol 4.13 propionitrile 3.17 vinylene carbonate 9.2 1,1,2-trichlorotrifluoroethane 73.21 DMS 4.7 cumene 1.03 2-octanol 4.16 2-hexanone 2.73 octyl acetate 2.4 limonene 2.97 1,2-dimethoxyethane 48.79 ethyl orthosilicate 3.33 tributyl phosphate 2.13 diacetone alcohol 17.82 N,N-dimethylaniline 5.93 acrylonitrile 7.32 aniline 4.53 1,3-propanediol 117.81 bromobenzene 0.68 dibromomethane 2.69 1,1,2,2-tetrachloroethane 7.23 2-methyl-cyclohexyl acetate 2.43 tetrabutyl urea 5.68 diisobutyl methanol 3.29 2-phenylethanol 6.12 styrene 0.87 dioctyl adipate 2.93 dimethyl sulfate 58.05 ethyl butyrate 3.31 methyl lactate 46.29 butyl lactate 6.19 diethyl carbonate 2.1 propanediol butyl ether 28.58 triethyl orthoformate 3.96 p-tert-butyltoluene 1.88 methyl 4-tert-butylbenzoate 10.53 morpholine 49.01 tert-butylamine 5.46 n-dodecanol 3.03 dimethoxymethane 90.11 ethylene carbonate 7.4 cyrene 45.09 2-ethoxyethyl acetate 5.25 2-ethylhexyl acetate 1.51 1,2,4-trichlorobenzene 1.85 4-methylpyridine 5.04 dibutyl ether 2.43 2,6-dimethyl-4-heptanol 3.29 DEF 43.48 dimethyl isosorbide 27.94 tetrachloroethylene 7.23 eugenol 15.03 triacetin 6.33 span 80 16.35 1,4-butanediol 64.73 1,1-dichloroethane 1.7 2-methyl-1-pentanol 5.2 methyl formate 70.22 2-methyl-1-butanol 8.18 n-decane 0.95 butyronitrile 3.44 3,7-dimethyl-1-octanol 3.45 1-chlorooctane 1.71 1-chlorotetradecane 0.82 n-nonane 0.99 undecane 0.71 tert-butylcyclohexane 0.38 cyclooctane 1.51 cyclopentanol 15.43 tetrahydropyran 8.53 tert-amyl methyl ether 5.79 2,5,8-trioxanonane 46.44 1-hexene 0.81 2-isopropoxyethanol 31.21 2,2,2-trifluoroethanol 65.27 methyl butyrate 4.49 Scent© AI
| 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 |