4,4,10,13,14-pentamethyl-17-(6-methylheptan-2-yl)-2,3,5,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
-
Identifiers
Molecular formula
C30H54SMILES
CC(C)CCCC(C)C1CCC2(C1(CCC3C2CCC4C3(CCCC4(C)C)C)C)C
-
Odor profile
Fragrance Woody 83.18% Dry 44.94% Amber 44.41% Waxy 43.34% Sandalwood 35.46% Balsamic 32.67% Fatty 32.28% Vetiver 31.78% Cedar 31.73% Spicy 31.62% Flavor Woody 44.45% Pine 28.42% Wood 27.35% Dry 24.21% Fir needle 24.18% Camphor 24.12% Sweet 23.01% Waxy 22.99% Spice 22.66% Old paper 22.55% Odor impact est.
Low -
Properties
XLogP3-AA
12.1pKa est.
8.58 (weak base)Molecular weight
414.7 g/molVapor pressure est.
- hPa @ 20°C
- hPa @ 25°C
Evaporation rate
Ultra slowBoiling point est.
465°CFlash point
- 214.4 ˚C est.
-
Synonyms
- DTXSID60963824
-
Applications
4,4,10,13,14-pentamethyl-17-(6-methylheptan-2-yl)-2,3,5,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene is a highly hydrogenated, steroid-like hydrocarbon. In practical terms, it is commonly evaluated as a non-polar reference scaffold in steroid chemistry and as a calibration standard for analytical methods (e.g., GC-MS). It may be used as an intermediate in pharmaceutical research and in the synthesis of steroid frameworks. It may also serve as a non-polar lubricant base component in industrial formulations and as a model compound for diffusion and solubility studies in polymers and plastics.
gpt-5-nano
-
Solubility @25˚C
Solvent Solubility (g/L) ethanol 19.39 methanol 3.58 isopropanol 23.37 water 0.06 ethyl acetate 109.18 n-propanol 34.49 acetone 71.19 n-butanol 48.99 acetonitrile 13.06 DMF 66.73 toluene 218.05 isobutanol 37.56 1,4-dioxane 173.77 methyl acetate 54.02 THF 411.03 2-butanone 96.94 n-pentanol 36.7 sec-butanol 29.2 n-hexane 28.33 ethylene glycol 1.02 NMP 172.34 cyclohexane 53.12 DMSO 24.2 n-butyl acetate 157.4 n-octanol 45.48 chloroform 169.81 n-propyl acetate 85.78 acetic acid 15.05 dichloromethane 123.33 cyclohexanone 239.48 propylene glycol 2.95 isopropyl acetate 155.3 DMAc 133.52 2-ethoxyethanol 38.35 isopentanol 61.72 n-heptane 39.64 ethyl formate 23.83 1,2-dichloroethane 94.56 n-hexanol 72.59 2-methoxyethanol 34.68 isobutyl acetate 110.98 tetrachloromethane 55.32 n-pentyl acetate 155.34 transcutol 214.14 n-heptanol 59.96 ethylbenzene 86.21 MIBK 148.99 2-propoxyethanol 116.36 tert-butanol 33.94 MTBE 121.05 2-butoxyethanol 104.43 propionic acid 22.21 o-xylene 125.28 formic acid 2.13 diethyl ether 149.23 m-xylene 175.85 p-xylene 110.12 chlorobenzene 143.33 dimethyl carbonate 49.38 n-octane 11.75 formamide 3.8 cyclopentanone 243.68 2-pentanone 137.88 anisole 134.11 cyclopentyl methyl ether 294.74 gamma-butyrolactone 171.13 1-methoxy-2-propanol 58.56 pyridine 156.26 3-pentanone 126.7 furfural 105.24 n-dodecane 5.49 diethylene glycol 25.22 diisopropyl ether 107.92 tert-amyl alcohol 36.56 acetylacetone 154.0 n-hexadecane 6.96 acetophenone 113.33 methyl propionate 96.22 isopentyl acetate 210.24 trichloroethylene 180.29 n-nonanol 54.01 cyclohexanol 75.45 benzyl alcohol 53.56 2-ethylhexanol 80.21 isooctanol 64.66 dipropyl ether 191.84 1,2-dichlorobenzene 138.15 ethyl lactate 34.24 propylene carbonate 101.47 n-methylformamide 14.34 2-pentanol 48.86 n-pentane 32.52 1-propoxy-2-propanol 129.64 1-methoxy-2-propyl acetate 238.59 2-(2-methoxypropoxy) propanol 97.79 mesitylene 123.95 ε-caprolactone 203.92 p-cymene 89.33 epichlorohydrin 165.61 1,1,1-trichloroethane 142.92 2-aminoethanol 4.67 morpholine-4-carbaldehyde 164.58 sulfolane 162.52 2,2,4-trimethylpentane 22.82 2-methyltetrahydrofuran 260.69 n-hexyl acetate 164.4 isooctane 22.58 2-(2-butoxyethoxy)ethanol 119.51 sec-butyl acetate 105.37 tert-butyl acetate 216.39 decalin 32.03 glycerin 5.57 diglyme 255.3 acrylic acid 15.14 isopropyl myristate 80.52 n-butyric acid 62.34 acetyl acetate 91.39 di(2-ethylhexyl) phthalate 61.17 ethyl propionate 99.03 nitromethane 28.79 1,2-diethoxyethane 159.52 benzonitrile 60.79 trioctyl phosphate 49.62 1-bromopropane 97.29 gamma-valerolactone 266.22 n-decanol 36.38 triethyl phosphate 86.45 4-methyl-2-pentanol 51.98 propionitrile 30.73 vinylene carbonate 83.07 1,1,2-trichlorotrifluoroethane 66.73 DMS 105.85 cumene 65.81 2-octanol 40.86 2-hexanone 94.5 octyl acetate 84.36 limonene 116.92 1,2-dimethoxyethane 110.14 ethyl orthosilicate 100.22 tributyl phosphate 53.08 diacetone alcohol 108.44 N,N-dimethylaniline 108.95 acrylonitrile 23.01 aniline 97.15 1,3-propanediol 16.01 bromobenzene 192.87 dibromomethane 101.36 1,1,2,2-tetrachloroethane 148.96 2-methyl-cyclohexyl acetate 155.5 tetrabutyl urea 76.62 diisobutyl methanol 67.96 2-phenylethanol 92.91 styrene 91.33 dioctyl adipate 100.37 dimethyl sulfate 69.56 ethyl butyrate 151.83 methyl lactate 29.47 butyl lactate 84.2 diethyl carbonate 87.55 propanediol butyl ether 48.22 triethyl orthoformate 159.37 p-tert-butyltoluene 98.05 methyl 4-tert-butylbenzoate 167.75 morpholine 164.78 tert-butylamine 34.96 n-dodecanol 25.83 dimethoxymethane 117.17 ethylene carbonate 82.17 cyrene 86.08 2-ethoxyethyl acetate 183.57 2-ethylhexyl acetate 199.2 1,2,4-trichlorobenzene 166.2 4-methylpyridine 174.65 dibutyl ether 101.7 2,6-dimethyl-4-heptanol 67.96 DEF 135.57 dimethyl isosorbide 225.41 tetrachloroethylene 101.34 eugenol 110.35 triacetin 140.61 span 80 86.79 1,4-butanediol 6.59 1,1-dichloroethane 95.6 2-methyl-1-pentanol 47.26 methyl formate 12.17 2-methyl-1-butanol 55.19 n-decane 14.67 butyronitrile 42.07 3,7-dimethyl-1-octanol 58.62 1-chlorooctane 50.66 1-chlorotetradecane 18.12 n-nonane 12.72 undecane 8.37 tert-butylcyclohexane 30.56 cyclooctane 30.67 cyclopentanol 60.24 tetrahydropyran 255.71 tert-amyl methyl ether 107.49 2,5,8-trioxanonane 152.9 1-hexene 58.75 2-isopropoxyethanol 49.1 2,2,2-trifluoroethanol 10.59 methyl butyrate 96.24 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 |