1,3,3-Trimethylbicyclo[2.2.1]heptan-2-YL 3-methylbutanoate
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Identifiers
Molecular formula
C15H26O2SMILES
CC(C)CC(=O)OC1C(C2CCC1(C2)C)(C)C
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Odor profile
Fragrance Herbal 66.21% Woody 57.1% Fruity 52.51% Pine 52.06% Mint 44.32% Balsamic 42.43% Camphoreous 42.19% Cooling 35.85% Spicy 34.27% Earthy 31.51% Flavor Herbal 51.49% Woody 50.16% Sweet 46.33% Camphor 40.83% Pine 40.36% Bitter 33.28% Citrus 29.18% Balsam 28.63% Green 26.19% Fir 24.45% Odor impact est.
Medium -
Properties
XLogP3-AA
4.3pKa est.
7.8 (neutral)Molecular weight
238.37 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
SlowBoiling point est.
268°CFlash point
- 118.69 ˚C est.
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Synonyms
- 1,3,3-TRIMETHYLBICYCLO[2.2.1]HEPTAN-2-YL 3-METHYLBUTANOATE
- bornylisovalerat
- SCHEMBL19919342
- DTXSID30975075
- UWEYUMKZEVARAF-UHFFFAOYSA-N
- NS00012018
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Applications
1,3,3-Trimethylbicyclo[2.2.1]heptan-2-YL 3-methylbutanoate is primarily used in perfumery as a fragrance fixative and odorant, helping to stabilize and extend the scent notes; it is also employed in cosmetics and personal care products as a scent component that provides woody, pine-like nuances; in household products such as air fresheners and detergents it contributes a lasting aroma; in coatings and inks as a fragrance additive to impart a subtle characteristic odor; and it can serve as an intermediate in industrial fragrance formulation.
gpt-5-nano
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Solubility @25˚C
Solvent Solubility (g/L) ethanol 3561.81 methanol 3170.14 isopropanol 4190.02 water 29.25 ethyl acetate 4363.67 n-propanol 3306.24 acetone 4736.42 n-butanol 3601.61 acetonitrile 3587.4 DMF 5418.0 toluene 2920.94 isobutanol 3531.35 1,4-dioxane 6383.75 methyl acetate 3699.2 THF 7505.29 2-butanone 3749.36 n-pentanol 2115.88 sec-butanol 3617.35 n-hexane 851.94 ethylene glycol 762.09 NMP 3188.74 cyclohexane 1464.61 DMSO 1810.97 n-butyl acetate 4157.21 n-octanol 1708.52 chloroform 9931.22 n-propyl acetate 2765.8 acetic acid 4232.98 dichloromethane 6096.64 cyclohexanone 5141.08 propylene glycol 1198.05 isopropyl acetate 4497.57 DMAc 4016.64 2-ethoxyethanol 2621.2 isopentanol 3979.95 n-heptane 408.76 ethyl formate 2957.77 1,2-dichloroethane 4522.75 n-hexanol 3458.73 2-methoxyethanol 4129.16 isobutyl acetate 2385.11 tetrachloromethane 2281.1 n-pentyl acetate 2443.97 transcutol 5971.74 n-heptanol 1648.76 ethylbenzene 1805.56 MIBK 3322.53 2-propoxyethanol 4689.91 tert-butanol 4494.5 MTBE 5709.98 2-butoxyethanol 2570.26 propionic acid 2601.46 o-xylene 1955.39 formic acid 1499.56 diethyl ether 4078.89 m-xylene 2414.91 p-xylene 2807.88 chlorobenzene 3321.59 dimethyl carbonate 1609.2 n-octane 235.3 formamide 2105.84 cyclopentanone 4691.51 2-pentanone 3806.15 anisole 2580.04 cyclopentyl methyl ether 3966.23 gamma-butyrolactone 4664.95 1-methoxy-2-propanol 3600.99 pyridine 4267.57 3-pentanone 2571.25 furfural 4036.39 n-dodecane 171.99 diethylene glycol 2485.84 diisopropyl ether 2395.25 tert-amyl alcohol 3847.28 acetylacetone 4245.55 n-hexadecane 202.43 acetophenone 2181.13 methyl propionate 2681.11 isopentyl acetate 4549.75 trichloroethylene 8346.78 n-nonanol 1468.4 cyclohexanol 3659.74 benzyl alcohol 1934.99 2-ethylhexanol 2079.59 isooctanol 1500.31 dipropyl ether 1792.83 1,2-dichlorobenzene 2797.63 ethyl lactate 1122.42 propylene carbonate 3588.53 n-methylformamide 2940.13 2-pentanol 3216.7 n-pentane 862.2 1-propoxy-2-propanol 3066.7 1-methoxy-2-propyl acetate 3475.48 2-(2-methoxypropoxy) propanol 1810.38 mesitylene 1731.35 ε-caprolactone 4917.7 p-cymene 997.88 epichlorohydrin 6060.86 1,1,1-trichloroethane 6433.16 2-aminoethanol 1716.4 morpholine-4-carbaldehyde 4503.56 sulfolane 3089.45 2,2,4-trimethylpentane 532.15 2-methyltetrahydrofuran 5890.98 n-hexyl acetate 3589.16 isooctane 484.81 2-(2-butoxyethoxy)ethanol 2559.51 sec-butyl acetate 2678.81 tert-butyl acetate 4307.06 decalin 718.36 glycerin 1407.69 diglyme 4392.63 acrylic acid 2145.1 isopropyl myristate 1215.54 n-butyric acid 4758.63 acetyl acetate 3413.14 di(2-ethylhexyl) phthalate 922.19 ethyl propionate 2372.13 nitromethane 5569.63 1,2-diethoxyethane 2990.71 benzonitrile 2844.85 trioctyl phosphate 734.9 1-bromopropane 3187.23 gamma-valerolactone 6307.3 n-decanol 1005.9 triethyl phosphate 901.41 4-methyl-2-pentanol 2392.98 propionitrile 2836.03 vinylene carbonate 3245.25 1,1,2-trichlorotrifluoroethane 3911.45 DMS 2419.55 cumene 1393.38 2-octanol 1351.64 2-hexanone 2531.36 octyl acetate 1467.18 limonene 1315.78 1,2-dimethoxyethane 4670.64 ethyl orthosilicate 981.28 tributyl phosphate 969.32 diacetone alcohol 3056.37 N,N-dimethylaniline 1686.08 acrylonitrile 2848.44 aniline 2646.16 1,3-propanediol 2748.94 bromobenzene 3420.69 dibromomethane 4280.37 1,1,2,2-tetrachloroethane 7114.69 2-methyl-cyclohexyl acetate 1772.92 tetrabutyl urea 1002.93 diisobutyl methanol 1158.46 2-phenylethanol 2538.78 styrene 1981.9 dioctyl adipate 1226.83 dimethyl sulfate 1718.09 ethyl butyrate 2283.89 methyl lactate 1462.34 butyl lactate 1696.14 diethyl carbonate 1456.17 propanediol butyl ether 2037.98 triethyl orthoformate 1599.91 p-tert-butyltoluene 1010.46 methyl 4-tert-butylbenzoate 1855.95 morpholine 6300.16 tert-butylamine 3373.94 n-dodecanol 726.09 dimethoxymethane 3631.99 ethylene carbonate 3223.88 cyrene 1262.53 2-ethoxyethyl acetate 2760.85 2-ethylhexyl acetate 3232.53 1,2,4-trichlorobenzene 3012.69 4-methylpyridine 5487.97 dibutyl ether 1873.58 2,6-dimethyl-4-heptanol 1158.46 DEF 3767.21 dimethyl isosorbide 2575.5 tetrachloroethylene 4957.42 eugenol 1625.68 triacetin 2013.4 span 80 1561.49 1,4-butanediol 1112.78 1,1-dichloroethane 6232.27 2-methyl-1-pentanol 2461.48 methyl formate 2539.78 2-methyl-1-butanol 3589.34 n-decane 320.82 butyronitrile 3732.31 3,7-dimethyl-1-octanol 1825.43 1-chlorooctane 1195.16 1-chlorotetradecane 447.27 n-nonane 316.69 undecane 221.62 tert-butylcyclohexane 673.29 cyclooctane 579.5 cyclopentanol 3042.58 tetrahydropyran 6248.73 tert-amyl methyl ether 3510.7 2,5,8-trioxanonane 2360.38 1-hexene 1985.42 2-isopropoxyethanol 2204.5 2,2,2-trifluoroethanol 2242.66 methyl butyrate 3124.57 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
|
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
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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 |