2,2-Dimethyl-6-vinylchromene
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Identifiers
Molecular formula
C13H14OSMILES
CC1(C=CC2=C(O1)C=CC(=C2)C=C)C
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Odor profile
Fragrance Spicy 57.54% Sweet 57.36% Herbal 56.15% Floral 55.13% Woody 44.46% Phenolic 38.27% Mint 37.63% Warm 30.74% Tobacco 30.62% Powdery 30.46% Flavor Floral 37.71% Woody 35.57% Sweet 33.13% Herbal 31.92% Bitter 30.61% Spice 30.51% Minty 28.9% Spicy 27.13% Mint 24.34% Tobacco 21.23% Odor impact est.
High -
Properties
XLogP3-AA
4.1pKa est.
7.77 (neutral)Molecular weight
186.25 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Very slowBoiling point est.
286°CFlash point
- 114.83 ˚C est.
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Synonyms
- 2,2-dimethyl-6-vinylchromene
- SCHEMBL3127352
- CHEMBL1824098
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Applications
2,2-Dimethyl-6-vinylchromene is an organic intermediate with practical industrial applications: it is used as a fragrance intermediate and cosmetic ingredient; regarded as a precursor for aroma-related compounds and for specialty polymer systems; it can act as a monomer or comonomer in polymer formulations; it is employed in coatings and inks as a colorant or photonic-functional component; and it can serve as an intermediate in general industrial manufacturing, including pharmaceutical synthesis.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 158.5 methanol 128.07 isopropanol 156.36 water 0.24 ethyl acetate 309.86 n-propanol 158.55 acetone 309.69 n-butanol 173.83 acetonitrile 175.18 DMF 454.06 toluene 223.1 isobutanol 145.33 1,4-dioxane 661.09 methyl acetate 357.22 THF 801.79 2-butanone 345.88 n-pentanol 150.45 sec-butanol 164.62 n-hexane 95.13 ethylene glycol 45.98 NMP 326.67 cyclohexane 97.36 DMSO 323.73 n-butyl acetate 299.5 n-octanol 145.04 chloroform 764.46 n-propyl acetate 202.42 acetic acid 97.52 dichloromethane 621.05 cyclohexanone 380.36 propylene glycol 84.77 isopropyl acetate 205.51 DMAc 537.06 2-ethoxyethanol 233.05 isopentanol 184.14 n-heptane 62.5 ethyl formate 136.58 1,2-dichloroethane 419.72 n-hexanol 243.95 2-methoxyethanol 291.95 isobutyl acetate 180.23 tetrachloromethane 102.08 n-pentyl acetate 180.72 transcutol 1047.3 n-heptanol 113.94 ethylbenzene 154.17 MIBK 206.49 2-propoxyethanol 400.68 tert-butanol 242.28 MTBE 412.51 2-butoxyethanol 187.46 propionic acid 125.74 o-xylene 150.47 formic acid 29.87 diethyl ether 404.52 m-xylene 170.77 p-xylene 182.84 chlorobenzene 246.12 dimethyl carbonate 177.69 n-octane 35.62 formamide 55.68 cyclopentanone 417.07 2-pentanone 260.22 anisole 308.98 cyclopentyl methyl ether 370.58 gamma-butyrolactone 377.5 1-methoxy-2-propanol 302.1 pyridine 320.59 3-pentanone 272.93 furfural 342.6 n-dodecane 34.26 diethylene glycol 254.37 diisopropyl ether 165.32 tert-amyl alcohol 219.64 acetylacetone 310.93 n-hexadecane 39.23 acetophenone 225.87 methyl propionate 281.62 isopentyl acetate 296.77 trichloroethylene 684.89 n-nonanol 134.27 cyclohexanol 180.4 benzyl alcohol 164.98 2-ethylhexanol 174.51 isooctanol 104.61 dipropyl ether 236.98 1,2-dichlorobenzene 235.72 ethyl lactate 112.0 propylene carbonate 240.16 n-methylformamide 128.99 2-pentanol 160.27 n-pentane 63.36 1-propoxy-2-propanol 286.59 1-methoxy-2-propyl acetate 325.88 2-(2-methoxypropoxy) propanol 260.51 mesitylene 124.12 ε-caprolactone 328.36 p-cymene 102.37 epichlorohydrin 549.16 1,1,1-trichloroethane 379.34 2-aminoethanol 83.97 morpholine-4-carbaldehyde 472.73 sulfolane 387.7 2,2,4-trimethylpentane 45.12 2-methyltetrahydrofuran 510.4 n-hexyl acetate 288.07 isooctane 43.64 2-(2-butoxyethoxy)ethanol 324.66 sec-butyl acetate 179.59 tert-butyl acetate 258.77 decalin 69.42 glycerin 107.23 diglyme 556.55 acrylic acid 105.71 isopropyl myristate 148.7 n-butyric acid 161.03 acetyl acetate 193.41 di(2-ethylhexyl) phthalate 119.19 ethyl propionate 200.53 nitromethane 218.77 1,2-diethoxyethane 484.65 benzonitrile 199.81 trioctyl phosphate 91.38 1-bromopropane 291.52 gamma-valerolactone 497.33 n-decanol 111.65 triethyl phosphate 124.46 4-methyl-2-pentanol 131.95 propionitrile 180.71 vinylene carbonate 237.05 1,1,2-trichlorotrifluoroethane 277.93 DMS 305.72 cumene 115.04 2-octanol 96.72 2-hexanone 237.21 octyl acetate 173.43 limonene 148.69 1,2-dimethoxyethane 452.42 ethyl orthosilicate 127.22 tributyl phosphate 122.4 diacetone alcohol 238.87 N,N-dimethylaniline 209.03 acrylonitrile 187.59 aniline 183.0 1,3-propanediol 130.22 bromobenzene 290.15 dibromomethane 418.7 1,1,2,2-tetrachloroethane 591.69 2-methyl-cyclohexyl acetate 200.08 tetrabutyl urea 147.97 diisobutyl methanol 115.59 2-phenylethanol 199.77 styrene 178.19 dioctyl adipate 174.15 dimethyl sulfate 225.73 ethyl butyrate 196.32 methyl lactate 134.42 butyl lactate 134.77 diethyl carbonate 153.29 propanediol butyl ether 197.02 triethyl orthoformate 163.69 p-tert-butyltoluene 109.52 methyl 4-tert-butylbenzoate 208.07 morpholine 550.06 tert-butylamine 180.74 n-dodecanol 95.71 dimethoxymethane 422.82 ethylene carbonate 209.41 cyrene 199.83 2-ethoxyethyl acetate 275.1 2-ethylhexyl acetate 255.09 1,2,4-trichlorobenzene 283.93 4-methylpyridine 350.44 dibutyl ether 265.01 2,6-dimethyl-4-heptanol 115.59 DEF 278.08 dimethyl isosorbide 401.33 tetrachloroethylene 327.63 eugenol 182.69 triacetin 289.25 span 80 204.29 1,4-butanediol 71.75 1,1-dichloroethane 390.61 2-methyl-1-pentanol 172.96 methyl formate 128.09 2-methyl-1-butanol 173.13 n-decane 50.14 butyronitrile 172.56 3,7-dimethyl-1-octanol 168.02 1-chlorooctane 153.02 1-chlorotetradecane 78.03 n-nonane 51.74 undecane 40.59 tert-butylcyclohexane 69.66 cyclooctane 48.75 cyclopentanol 160.44 tetrahydropyran 532.8 tert-amyl methyl ether 309.73 2,5,8-trioxanonane 416.98 1-hexene 189.56 2-isopropoxyethanol 212.98 2,2,2-trifluoroethanol 56.32 methyl butyrate 223.22 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 |
| Name | CAS | Botanical | Proportion |
|---|---|---|---|
| Vassoura (Brazil) 3 | Baccharis dracunculifolia DC., fam. Asteraceae (Compositae) | 0.2% |