Carthamin
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Identifiers
CAS number
36338-96-2Molecular formula
C43H42O22SMILES
C1=CC(=CC=C1/C=C/C(=O)C2=C([C@@](C(=C(C2=O)/C=C\3/C(=O)C(=C([C@](C3=O)([C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)C(=O)/C=C/C5=CC=C(C=C5)O)O)([C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)O)O
Safety labels
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Odor profile
Fragrance Odorless 64.9% Sweet 35.81% Caramellic 24.86% Spicy 24.55% Burnt 22.9% Savory 22.89% Vanilla 21.28% Bitter 21.22% Milky 19.48% Balsamic 16.4% Flavor Bitter 90.31% Odorless 32.88% Bland 25.68% Sweet-like 21.85% Very mild 20.89% Cedarleaf 19.25% Nitrile 19.15% Lovage 18.94% Parsley 18.06% Fenugreek 17.96% Odor impact est.
Low -
Properties
XLogP3-AA
-2.5pKa est.
0.86 (strong acid)Molecular weight
910.8 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Ultra slowBoiling point est.
6321°CFlash point
- 345.25 ˚C est.
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Synonyms
- 36338-96-2
- Carthamin
- Carthamine
- Carthamus red
- Natural Red 26
- Liofresh Red CR
- Carthamus Red AP
- C.I. Natural Red 26
- CARTHAMIN [MI]
- LIOFRESH RED CR-7000
- DTXSID50897503
- EINECS 252-981-1
- 4-CYCLOHEXENE-1,3-DIONE, 6-.BETA.-D-GLUCOPYRANOSYL-2-((3-.BETA.-D-GLUCOPYRANOSYL-2,3,4-TRIHYDROXY-5-(3-(4-HYDROXYPHENYL)-1-OXO-2-PROPENYL)-6-OXO-1,4-CYCLOHEXADIEN-1-YL)METHYLENE)-5,6-DIHYDROXY-4-(3-(4-HYDROXYPHENYL)-1-OXO-2-PROPENYL)-, (S-(R*,R*))-
- (2E)-5,6-dihydroxy-4-((E)-3-(4-hydroxyphenyl)prop-2-enoyl)-6-(3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)-2-((2,3,4-trihydroxy-5-((E)-3-(4-hydroxyphenyl)prop-2-enoyl)-6-oxo-3-(3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)cyclohexa-1,4-dien-1-yl)methylidene)cyclohex-4-ene-1,3-dione
- (2E)-5,6-dihydroxy-4-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-[[2,3,4-trihydroxy-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-oxo-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexa-1,4-dien-1-yl]methylidene]cyclohex-4-ene-1,3-dione
- RefChem:574738
- NATURAL RED 26 [INCI]
- DTXCID301326858
- 4-CYCLOHEXENE-1,3-DIONE, 6-BETA-D-GLUCOPYRANOSYL-2-((3-BETA-D-GLUCOPYRANOSYL-2,3,4-TRIHYDROXY-5-(3-(4-HYDROXYPHENYL)-1-OXO-2-PROPENYL)-6-OXO-1,4-CYCLOHEXADIEN-1-YL)METHYLENE)-5,6-DIHYDROXY-4-(3-(4-HYDROXYPHENYL)-1-OXO-2-PROPENYL)-, (S-(R*,R*))-
- Carthamus
- P9ZT730WWS
- UNII-P9ZT730WWS
- (S,Z)-5,6-Dihydroxy-4-((E)-3-(4-hydroxyphenyl)acryloyl)-2-(((S)-2,3,4-trihydroxy-5-((E)-3-(4-hydroxyphenyl)acryloyl)-6-oxo-3-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)cyclohexa-1,4-dien-1-yl)methylene)-6-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)cyclohex-4-ene-1,3-dione
- C43H42O22
- SCHEMBL121899
- orb1300925
- CHEBI:80810
- HMS3886K13
- color value 30 (E1%,1cm,5)
- HY-N6646
- s5110
- AKOS030526139
- CCG-270568
- FC66320
- AS-18743
- CS-0063546
- C16941
- C74870
- Q419193
- (2Z,6S)-5,6-Dihydroxy-4-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-({(3S)-2,3,4-trihydroxy-5-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-oxo-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexa-1,4-dien-1-yl}methylidene)cyclohex-4-ene-1,3-dione
- (2Z,6S)-5,6-dihydroxy-4-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-[[(3S)-2,3,4-trihydroxy-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-oxo-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexa-1,4-dien-1-yl]methylidene]cyclohex-4-ene-1,3-dione
- (2Z,6S)-5,6-dihydroxy-4-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]-2-[[(3S)-2,3,4-trihydroxy-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-oxo-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]cyclohexa-1,4-dien-1-yl]methylene]cyclohex-4-ene-1,3-dione
- 4-Cyclohexene-1,3-dione, 6-beta-D-glucopyranosyl-2-((3-beta-D-glucopyranosyl-2,3,4-trihydroxy-5-(3-(4-hydroxyphenyl)-1-oxo-2-propenyl)-6-oxo-1,4-cyclohexadien-1-yl)methylene)-5,6-dihydroxy-4-(3-(4-hydroxyphenyl)-1-oxo-2-propenyl)-
- 36338-96-2
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Applications
Carthamin (CAS 36338-96-2) is a natural red pigment derived from safflower (Carthamus tinctorius). In practice, it is used as a colorant in cosmetics and personal care products; as a pigment for coatings, paints, and printing inks; considered as a natural food colorant in select markets; and used as a colorant in plastics and rubber formulations to impart red hues. Its use is subject to local regulations and formulation limits.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 5.63 methanol 16.84 isopropanol 1.88 water 0.17 ethyl acetate 0.99 n-propanol 3.36 acetone 4.62 n-butanol 1.41 acetonitrile 0.94 DMF 41.37 toluene 0.38 isobutanol 0.94 1,4-dioxane 6.2 methyl acetate 1.95 THF 15.21 2-butanone 3.38 n-pentanol 0.75 sec-butanol 1.28 n-hexane 0.03 ethylene glycol 9.5 NMP 32.32 cyclohexane 0.04 DMSO 54.34 n-butyl acetate 0.28 n-octanol 0.36 chloroform 0.65 n-propyl acetate 0.47 acetic acid 11.78 dichloromethane 0.85 cyclohexanone 3.08 propylene glycol 9.4 isopropyl acetate 0.47 DMAc 31.71 2-ethoxyethanol 7.8 isopentanol 0.49 n-heptane 0.03 ethyl formate 1.83 1,2-dichloroethane 0.69 n-hexanol 0.32 2-methoxyethanol 23.36 isobutyl acetate 0.14 tetrachloromethane 0.12 n-pentyl acetate 0.47 transcutol 5.07 n-heptanol 0.44 ethylbenzene 0.11 MIBK 0.48 2-propoxyethanol 4.37 tert-butanol 0.74 MTBE 0.39 2-butoxyethanol 2.63 propionic acid 3.53 o-xylene 0.2 formic acid 21.59 diethyl ether 0.98 m-xylene 0.16 p-xylene 0.1 chlorobenzene 0.15 dimethyl carbonate 3.19 n-octane 0.02 formamide 21.32 cyclopentanone 8.01 2-pentanone 1.67 anisole 0.48 cyclopentyl methyl ether 1.63 gamma-butyrolactone 10.3 1-methoxy-2-propanol 11.3 pyridine 3.82 3-pentanone 1.25 furfural 6.72 n-dodecane 0.01 diethylene glycol 7.03 diisopropyl ether 0.09 tert-amyl alcohol 0.62 acetylacetone 2.72 n-hexadecane 0.01 acetophenone 0.64 methyl propionate 2.4 isopentyl acetate 0.16 trichloroethylene 1.13 n-nonanol 0.35 cyclohexanol 0.73 benzyl alcohol 0.95 2-ethylhexanol 0.12 isooctanol 0.23 dipropyl ether 0.47 1,2-dichlorobenzene 0.11 ethyl lactate 1.23 propylene carbonate 1.93 n-methylformamide 19.16 2-pentanol 0.52 n-pentane 0.05 1-propoxy-2-propanol 2.24 1-methoxy-2-propyl acetate 1.12 2-(2-methoxypropoxy) propanol 1.69 mesitylene 0.07 ε-caprolactone 2.66 p-cymene 0.05 epichlorohydrin 6.36 1,1,1-trichloroethane 0.16 2-aminoethanol 9.71 morpholine-4-carbaldehyde 21.17 sulfolane 20.62 2,2,4-trimethylpentane 0.01 2-methyltetrahydrofuran 2.56 n-hexyl acetate 0.45 isooctane 0.01 2-(2-butoxyethoxy)ethanol 2.48 sec-butyl acetate 0.22 tert-butyl acetate 0.41 decalin 0.01 glycerin 21.88 diglyme 4.79 acrylic acid 5.91 isopropyl myristate 0.13 n-butyric acid 2.15 acetyl acetate 0.58 di(2-ethylhexyl) phthalate 0.19 ethyl propionate 0.57 nitromethane 14.42 1,2-diethoxyethane 0.9 benzonitrile 0.33 trioctyl phosphate 0.19 1-bromopropane 0.31 gamma-valerolactone 19.05 n-decanol 0.23 triethyl phosphate 0.2 4-methyl-2-pentanol 0.16 propionitrile 0.84 vinylene carbonate 2.06 1,1,2-trichlorotrifluoroethane 9.76 DMS 0.67 cumene 0.05 2-octanol 0.22 2-hexanone 0.61 octyl acetate 0.26 limonene 0.08 1,2-dimethoxyethane 6.82 ethyl orthosilicate 0.18 tributyl phosphate 0.16 diacetone alcohol 1.95 N,N-dimethylaniline 0.41 acrylonitrile 1.83 aniline 0.94 1,3-propanediol 7.77 bromobenzene 0.09 dibromomethane 0.38 1,1,2,2-tetrachloroethane 1.0 2-methyl-cyclohexyl acetate 0.18 tetrabutyl urea 0.41 diisobutyl methanol 0.06 2-phenylethanol 0.43 styrene 0.13 dioctyl adipate 0.29 dimethyl sulfate 6.21 ethyl butyrate 0.35 methyl lactate 6.02 butyl lactate 0.92 diethyl carbonate 0.21 propanediol butyl ether 2.97 triethyl orthoformate 0.35 p-tert-butyltoluene 0.05 methyl 4-tert-butylbenzoate 0.78 morpholine 10.51 tert-butylamine 0.21 n-dodecanol 0.14 dimethoxymethane 15.42 ethylene carbonate 1.49 cyrene 3.85 2-ethoxyethyl acetate 1.14 2-ethylhexyl acetate 0.12 1,2,4-trichlorobenzene 0.19 4-methylpyridine 1.51 dibutyl ether 0.23 2,6-dimethyl-4-heptanol 0.06 DEF 3.51 dimethyl isosorbide 2.2 tetrachloroethylene 0.79 eugenol 0.93 triacetin 0.85 span 80 1.61 1,4-butanediol 2.56 1,1-dichloroethane 0.31 2-methyl-1-pentanol 0.3 methyl formate 12.26 2-methyl-1-butanol 0.63 n-decane 0.03 butyronitrile 0.54 3,7-dimethyl-1-octanol 0.13 1-chlorooctane 0.09 1-chlorotetradecane 0.03 n-nonane 0.03 undecane 0.02 tert-butylcyclohexane 0.01 cyclooctane 0.02 cyclopentanol 2.01 tetrahydropyran 2.19 tert-amyl methyl ether 0.41 2,5,8-trioxanonane 3.07 1-hexene 0.1 2-isopropoxyethanol 2.45 2,2,2-trifluoroethanol 4.41 methyl butyrate 0.85 Scent© AI
| Maximum acceptable concentrations in the finished product (%) | |||
|---|---|---|---|
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Category 1
Products applied to the lips
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No restriction |
Category 7A
Rinse-off products applied to the hair with some hand contact
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No restriction |
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Category 2
Products applied to the axillae
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No restriction |
Category 7B
Leave-on products applied to the hair with some hand contact
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No restriction |
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Category 3
Products applied to the face/body using fingertips
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No restriction |
Category 8
Products with significant anogenital exposure
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No restriction |
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Category 4
Products related to fine fragrance
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No restriction |
Category 9
Products with body and hand exposure, primarily rinse off
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No restriction |
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Category 5A
Body lotion products applied to the body using the hands (palms), primarily leave on
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No restriction |
Category 10A
Household care products with mostly hand contact
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No restriction |
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Category 5B
Face moisturizer products applied to the face using the hands (palms), primarily leave on
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No restriction |
Category 10B
Household care products with mostly hand contact, including aerosol/spray products (with potential leave-on skin contact)
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No restriction |
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Category 5C
Hand cream products applied to the hands using the hands (palms), primarily leave on
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No restriction |
Category 11A
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
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No restriction |
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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 |
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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 |