Mangiferonic Acid
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Identifiers
CAS number
13878-90-5Molecular formula
C30H46O3SMILES
C[C@H](CC/C=C(\C)/C(=O)O)[C@H]1CC[C@@]2([C@@]1(CC[C@]34[C@H]2CC[C@@H]5[C@]3(C4)CCC(=O)C5(C)C)C)C
Safety labels
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Odor profile
Fragrance Woody 87.37% Amber 55.83% Sandalwood 50.79% Dry 47.31% Cedar 44.88% Musk 40.13% Vetiver 39.87% Powdery 35.35% Balsamic 33.32% Animal 31.56% Flavor Woody 61.72% Balsam 28.37% Herbal 27.68% Wood 26.02% Camphor 25.01% Sandalwood 22.0% Pine 21.82% Fir needle 21.66% Balsamic 20.03% Ripe apricot 19.88% Odor impact est.
Low -
Properties
XLogP3-AA
8.2pKa est.
7.17 (neutral)Molecular weight
454.7 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
SlowBoiling point est.
475°CFlash point
- 204.11 ˚C est.
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Synonyms
- Mangiferonic acid
- 13878-90-5
- (24E)-3-Oxo-9,19-cyclolanost-24-en-26-oic acid
- 9,19-Cyclolanost-24-en-26-oic acid, 3-oxo-, (24E)-
- (E,6R)-2-methyl-6-[(1S,3R,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-6-oxo-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]hept-2-enoic acid
- Mangiferonate
- (E,6R)-2-methyl-6-((1S,3R,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-6-oxo-15-pentacyclo(9.7.0.01,3.03,8.012,16)octadecanyl)hept-2-enoic acid
- RefChem:155620
- 3-Oxo-(24E)-9,19-Cyclolanost-24-en-26-oic acid
- CHEMBL490331
- SCHEMBL30415919
- CHEBI:172009
- DTXSID901316348
- (24E)-3-Oxo-9beta,19-cyclo-5alpha-lanost-24-en-26-oic acid
- (24E)-3-Oxo-9beta-9,19-cyclolanost-24-en-26-oic acid
- 13878-90-5
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Applications
Mangiferonic Acid (CAS 13878-90-5) may serve as an intermediate in organic synthesis and potentially act as an antioxidant/stabilizer in polymers and coatings; in cosmetics and personal care it could function as an antioxidant ingredient; in pharmaceutical development it may be used as a synthesis building block for active compounds; and in industrial manufacturing it may be considered as an additive for plastics, inks, or adhesives, with actual use governed by local regulations and formulation limits.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 5.38 methanol 3.06 isopropanol 5.24 water 0.01 ethyl acetate 3.48 n-propanol 6.25 acetone 4.09 n-butanol 5.72 acetonitrile 1.44 DMF 8.96 toluene 3.38 isobutanol 4.01 1,4-dioxane 7.83 methyl acetate 2.8 THF 12.45 2-butanone 5.43 n-pentanol 3.64 sec-butanol 3.23 n-hexane 0.16 ethylene glycol 0.68 NMP 8.24 cyclohexane 0.2 DMSO 3.75 n-butyl acetate 3.68 n-octanol 1.6 chloroform 9.49 n-propyl acetate 2.6 acetic acid 3.59 dichloromethane 5.03 cyclohexanone 7.42 propylene glycol 1.41 isopropyl acetate 4.4 DMAc 12.46 2-ethoxyethanol 7.97 isopentanol 4.54 n-heptane 0.13 ethyl formate 1.64 1,2-dichloroethane 3.14 n-hexanol 4.39 2-methoxyethanol 10.48 isobutyl acetate 2.88 tetrachloromethane 1.76 n-pentyl acetate 4.84 transcutol 16.05 n-heptanol 3.32 ethylbenzene 1.63 MIBK 4.77 2-propoxyethanol 18.49 tert-butanol 4.0 MTBE 3.59 2-butoxyethanol 11.47 propionic acid 3.06 o-xylene 1.89 formic acid 1.43 diethyl ether 3.77 m-xylene 2.43 p-xylene 1.76 chlorobenzene 3.01 dimethyl carbonate 2.92 n-octane 0.06 formamide 2.14 cyclopentanone 7.69 2-pentanone 4.99 anisole 4.47 cyclopentyl methyl ether 4.58 gamma-butyrolactone 6.3 1-methoxy-2-propanol 13.07 pyridine 7.63 3-pentanone 4.14 furfural 6.25 n-dodecane 0.03 diethylene glycol 8.42 diisopropyl ether 1.37 tert-amyl alcohol 2.91 acetylacetone 5.92 n-hexadecane 0.04 acetophenone 4.13 methyl propionate 4.07 isopentyl acetate 5.04 trichloroethylene 7.63 n-nonanol 2.0 cyclohexanol 2.99 benzyl alcohol 4.38 2-ethylhexanol 2.07 isooctanol 2.79 dipropyl ether 2.47 1,2-dichlorobenzene 2.92 ethyl lactate 2.58 propylene carbonate 3.54 n-methylformamide 3.56 2-pentanol 2.98 n-pentane 0.21 1-propoxy-2-propanol 11.27 1-methoxy-2-propyl acetate 9.42 2-(2-methoxypropoxy) propanol 7.49 mesitylene 1.35 ε-caprolactone 6.49 p-cymene 1.17 epichlorohydrin 8.56 1,1,1-trichloroethane 3.65 2-aminoethanol 2.78 morpholine-4-carbaldehyde 12.61 sulfolane 7.42 2,2,4-trimethylpentane 0.17 2-methyltetrahydrofuran 4.87 n-hexyl acetate 4.53 isooctane 0.15 2-(2-butoxyethoxy)ethanol 9.3 sec-butyl acetate 2.51 tert-butyl acetate 5.52 decalin 0.19 glycerin 2.81 diglyme 16.01 acrylic acid 2.6 isopropyl myristate 1.46 n-butyric acid 5.52 acetyl acetate 3.08 di(2-ethylhexyl) phthalate 2.9 ethyl propionate 2.84 nitromethane 4.38 1,2-diethoxyethane 4.55 benzonitrile 2.71 trioctyl phosphate 1.75 1-bromopropane 2.14 gamma-valerolactone 15.94 n-decanol 1.11 triethyl phosphate 2.16 4-methyl-2-pentanol 2.54 propionitrile 2.77 vinylene carbonate 4.07 1,1,2-trichlorotrifluoroethane 8.16 DMS 4.0 cumene 1.19 2-octanol 1.51 2-hexanone 3.69 octyl acetate 1.98 limonene 1.27 1,2-dimethoxyethane 8.79 ethyl orthosilicate 2.58 tributyl phosphate 1.52 diacetone alcohol 7.0 N,N-dimethylaniline 3.36 acrylonitrile 2.97 aniline 4.42 1,3-propanediol 5.66 bromobenzene 2.8 dibromomethane 3.52 1,1,2,2-tetrachloroethane 6.05 2-methyl-cyclohexyl acetate 3.77 tetrabutyl urea 2.4 diisobutyl methanol 1.52 2-phenylethanol 6.57 styrene 1.69 dioctyl adipate 2.58 dimethyl sulfate 4.15 ethyl butyrate 2.87 methyl lactate 3.9 butyl lactate 5.16 diethyl carbonate 1.9 propanediol butyl ether 6.02 triethyl orthoformate 3.5 p-tert-butyltoluene 1.26 methyl 4-tert-butylbenzoate 7.4 morpholine 10.45 tert-butylamine 2.04 n-dodecanol 0.59 dimethoxymethane 10.19 ethylene carbonate 3.44 cyrene 7.19 2-ethoxyethyl acetate 8.03 2-ethylhexyl acetate 3.65 1,2,4-trichlorobenzene 4.22 4-methylpyridine 6.36 dibutyl ether 1.12 2,6-dimethyl-4-heptanol 1.52 DEF 4.95 dimethyl isosorbide 11.73 tetrachloroethylene 4.59 eugenol 8.36 triacetin 5.51 span 80 5.99 1,4-butanediol 2.04 1,1-dichloroethane 3.27 2-methyl-1-pentanol 3.05 methyl formate 1.86 2-methyl-1-butanol 3.68 n-decane 0.09 butyronitrile 2.97 3,7-dimethyl-1-octanol 1.6 1-chlorooctane 0.56 1-chlorotetradecane 0.15 n-nonane 0.07 undecane 0.05 tert-butylcyclohexane 0.18 cyclooctane 0.1 cyclopentanol 2.96 tetrahydropyran 5.81 tert-amyl methyl ether 2.66 2,5,8-trioxanonane 9.89 1-hexene 0.73 2-isopropoxyethanol 5.96 2,2,2-trifluoroethanol 1.88 methyl butyrate 2.98 Scent© AI
| Maximum acceptable concentrations in the finished product (%) | |||
|---|---|---|---|
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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
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No restriction |
Category 11B
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
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No restriction |
|
Category 6
Products with oral and lip exposure
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No restriction |
Category 12
Products not intended for direct skin contact, minimal or insignificant transfer to skin
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No restriction |