4,7-Methano-1H-inden-5-ol, 3a,4,5,6,7,7a-hexahydrodimethyl-
-
Identifiers
Molecular formula
C12H18OSMILES
CC1C2C3CC(C2C=C1C)C(C3)O
-
Odor profile
Fragrance Woody 76.4% Herbal 61.15% Spicy 55.53% Earthy 44.39% Balsamic 39.76% Camphoreous 35.95% Sweet 33.76% Mint 32.5% Fresh 32.18% Pine 29.47% Flavor Herbal 39.22% Bitter 36.0% Herb 34.61% Fruity 27.55% Fruit 26.79% Fresh 26.0% Fatty 24.15% Cedarleaf 23.53% Green tea 22.18% Mentholic 21.55% Odor impact est.
High -
Properties
XLogP3-AA
1.8pKa est.
9.05 (weak base)Molecular weight
178.27 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
SlowBoiling point est.
292°CFlash point
- 90.58 ˚C est.
-
Synonyms
- 4,7-Methano-1H-inden-5-ol, 3a,4,5,6,7,7a-hexahydrodimethyl-
- DTXSID001015303
- 4,7-Methano-1H-inden-5-ol, 3a,4,5,6,7,7a-hexahydro-2(or 3),4-dimethyl-
- WJYPOGJOWNDSPL-UHFFFAOYSA-N
- DTXCID301473615
- NS00126337
-
Applications
4,7-Methano-1H-inden-5-ol, 3a,4,5,6,7,7a-hexahydrodimethyl- is a bicyclic, saturated alcohol that is frequently treated as an intermediate and fragrance-related additive in a range of industrial syntheses. In practical terms, typical applications include: 1) fragrance and cosmetics, serving as a fragrance ingredient and fixative to help stabilize aroma; 2) household and consumer goods, used as a fragrance component in cleaners, soaps, shampoos and detergents; 3) pharmaceutical and agrochemical research, acting as an intermediate or building block for more complex organic molecules; 4) polymers and plastics, used as a chiral building block or intermediate for specialty polymers; 5) flavor applications, evaluated as an aroma compound for food and beverage formulations within regulatory limits.
gpt-5-nano
-
Solubility @25˚C
Solvent Solubility (g/L) ethanol 739.04 methanol 657.32 isopropanol 1010.59 water 10.7 ethyl acetate 919.11 n-propanol 749.78 acetone 1521.22 n-butanol 794.05 acetonitrile 1300.49 DMF 948.65 toluene 587.64 isobutanol 578.28 1,4-dioxane 2062.33 methyl acetate 859.28 THF 2812.99 2-butanone 895.88 n-pentanol 223.16 sec-butanol 420.47 n-hexane 27.37 ethylene glycol 179.51 NMP 403.31 cyclohexane 104.18 DMSO 664.52 n-butyl acetate 493.77 n-octanol 199.42 chloroform 2058.11 n-propyl acetate 340.26 acetic acid 434.87 dichloromethane 1903.29 cyclohexanone 877.67 propylene glycol 225.75 isopropyl acetate 591.24 DMAc 429.28 2-ethoxyethanol 418.26 isopentanol 594.08 n-heptane 51.62 ethyl formate 648.8 1,2-dichloroethane 952.04 n-hexanol 427.34 2-methoxyethanol 1069.8 isobutyl acetate 232.4 tetrachloromethane 342.86 n-pentyl acetate 266.74 transcutol 1446.01 n-heptanol 202.36 ethylbenzene 180.38 MIBK 509.04 2-propoxyethanol 807.95 tert-butanol 856.99 MTBE 746.44 2-butoxyethanol 399.56 propionic acid 389.33 o-xylene 277.29 formic acid 171.27 diethyl ether 874.97 m-xylene 389.58 p-xylene 234.43 chlorobenzene 533.92 dimethyl carbonate 356.07 n-octane 24.64 formamide 351.42 cyclopentanone 1296.66 2-pentanone 791.57 anisole 405.93 cyclopentyl methyl ether 711.77 gamma-butyrolactone 1344.94 1-methoxy-2-propanol 867.41 pyridine 1022.0 3-pentanone 487.62 furfural 817.47 n-dodecane 23.73 diethylene glycol 600.01 diisopropyl ether 256.22 tert-amyl alcohol 347.21 acetylacetone 861.51 n-hexadecane 27.59 acetophenone 292.29 methyl propionate 607.64 isopentyl acetate 448.72 trichloroethylene 1432.46 n-nonanol 173.98 cyclohexanol 441.18 benzyl alcohol 283.41 2-ethylhexanol 203.97 isooctanol 163.59 dipropyl ether 349.49 1,2-dichlorobenzene 410.49 ethyl lactate 171.0 propylene carbonate 581.85 n-methylformamide 659.83 2-pentanol 427.68 n-pentane 67.63 1-propoxy-2-propanol 521.35 1-methoxy-2-propyl acetate 545.59 2-(2-methoxypropoxy) propanol 318.32 mesitylene 235.8 ε-caprolactone 664.4 p-cymene 153.29 epichlorohydrin 1483.65 1,1,1-trichloroethane 939.65 2-aminoethanol 325.04 morpholine-4-carbaldehyde 776.43 sulfolane 730.99 2,2,4-trimethylpentane 31.65 2-methyltetrahydrofuran 1127.68 n-hexyl acetate 357.39 isooctane 43.67 2-(2-butoxyethoxy)ethanol 510.69 sec-butyl acetate 233.89 tert-butyl acetate 522.01 decalin 40.44 glycerin 313.52 diglyme 999.01 acrylic acid 329.57 isopropyl myristate 160.32 n-butyric acid 720.85 acetyl acetate 557.36 di(2-ethylhexyl) phthalate 146.21 ethyl propionate 314.73 nitromethane 1120.78 1,2-diethoxyethane 572.09 benzonitrile 480.16 trioctyl phosphate 111.28 1-bromopropane 582.75 gamma-valerolactone 1306.81 n-decanol 131.22 triethyl phosphate 132.89 4-methyl-2-pentanol 269.93 propionitrile 926.04 vinylene carbonate 639.81 1,1,2-trichlorotrifluoroethane 541.19 DMS 312.55 cumene 125.64 2-octanol 131.31 2-hexanone 288.21 octyl acetate 181.46 limonene 187.46 1,2-dimethoxyethane 759.98 ethyl orthosilicate 130.93 tributyl phosphate 127.42 diacetone alcohol 466.41 N,N-dimethylaniline 196.72 acrylonitrile 888.58 aniline 524.66 1,3-propanediol 639.2 bromobenzene 571.6 dibromomethane 1116.3 1,1,2,2-tetrachloroethane 891.75 2-methyl-cyclohexyl acetate 225.38 tetrabutyl urea 145.48 diisobutyl methanol 173.42 2-phenylethanol 344.53 styrene 214.52 dioctyl adipate 182.36 dimethyl sulfate 347.48 ethyl butyrate 334.07 methyl lactate 283.92 butyl lactate 205.19 diethyl carbonate 222.69 propanediol butyl ether 320.54 triethyl orthoformate 218.56 p-tert-butyltoluene 158.34 methyl 4-tert-butylbenzoate 291.06 morpholine 1575.94 tert-butylamine 517.89 n-dodecanol 101.96 dimethoxymethane 1095.59 ethylene carbonate 586.37 cyrene 246.65 2-ethoxyethyl acetate 429.89 2-ethylhexyl acetate 303.02 1,2,4-trichlorobenzene 421.57 4-methylpyridine 857.59 dibutyl ether 250.96 2,6-dimethyl-4-heptanol 173.42 DEF 464.07 dimethyl isosorbide 513.0 tetrachloroethylene 566.91 eugenol 274.91 triacetin 320.69 span 80 261.72 1,4-butanediol 160.14 1,1-dichloroethane 1155.07 2-methyl-1-pentanol 193.21 methyl formate 599.22 2-methyl-1-butanol 403.29 n-decane 38.66 butyronitrile 885.79 3,7-dimethyl-1-octanol 199.53 1-chlorooctane 136.67 1-chlorotetradecane 59.74 n-nonane 35.31 undecane 29.52 tert-butylcyclohexane 39.39 cyclooctane 43.68 cyclopentanol 531.58 tetrahydropyran 1468.35 tert-amyl methyl ether 297.16 2,5,8-trioxanonane 577.51 1-hexene 107.02 2-isopropoxyethanol 307.8 2,2,2-trifluoroethanol 257.54 methyl butyrate 356.33 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 |