Molecular formula
C14H22O

SMILES
CC1CC(C(=O)C(=C1)C)(C)CC=C(C)C

Fragrance
Herbal	71.2%
Floral	62.94%
Fresh	56.93%
Citrus	56.09%
Mint	47.66%
Woody	42.11%
Spicy	41.04%
Fruity	38.66%
Grapefruit	37.46%
Sweet	36.61%

 

Flavor
Woody	58.89%
Herbal	45.15%
Spicy	41.5%
Minty	34.55%
Floral	31.76%
Fresh	30.98%
Sweet	29.29%
Camphor	28.88%
Wood	28.76%
Dry	26.95%

 

Odor impact est.
High

XLogP3-AA
4.0

pKa est.
9.12 (weak base)

Molecular weight
206.32 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Slow

Boiling point est.
259°C

Flash point

• 109.11 ˚C est.

• SCHEMBL2184267

2,4,6-Trimethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-one is a fragrance ingredient primarily used in perfumery and cosmetics/personal care, serving as a fragrance note and odorant. It is also applied in household products and cleaners as an odorant to provide a long-lasting aroma. In coatings, inks, and adhesives, it often serves as a fragrance additive to enhance scent characteristics of the formulations. As an intermediate in fragrance chemistry and polymer-related material synthesis, it may be evaluated for processes in polymers/plastics and aroma systems. Additional industrial assessments may consider it as a fragrance additive for other product classes contingent on local regulations.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	1267.01
methanol	1011.6
isopropanol	1304.59
water	1.17
ethyl acetate	2046.81
n-propanol	1325.81
acetone	1820.16
n-butanol	1570.22
acetonitrile	1356.35
DMF	2267.26
toluene	1936.82
isobutanol	1367.71
1,4-dioxane	2659.27
methyl acetate	1542.85
THF	3198.95
2-butanone	1890.79
n-pentanol	851.46
sec-butanol	1296.46
n-hexane	646.79
ethylene glycol	111.12
NMP	1588.6
cyclohexane	834.65
DMSO	609.27
n-butyl acetate	1675.35
n-octanol	599.23
chloroform	3878.34
n-propyl acetate	979.45
acetic acid	960.71
dichloromethane	2689.31
cyclohexanone	2654.09
propylene glycol	222.39
isopropyl acetate	1670.26
DMAc	1741.43
2-ethoxyethanol	837.37
isopentanol	1792.04
n-heptane	230.3
ethyl formate	880.1
1,2-dichloroethane	2179.75
n-hexanol	1560.47
2-methoxyethanol	1445.04
isobutyl acetate	808.93
tetrachloromethane	898.48
n-pentyl acetate	968.4
transcutol	2825.93
n-heptanol	665.04
ethylbenzene	938.39
MIBK	1492.2
2-propoxyethanol	1702.28
tert-butanol	1718.47
MTBE	2787.08
2-butoxyethanol	995.12
propionic acid	739.97
o-xylene	1059.46
formic acid	234.73
diethyl ether	2784.6
m-xylene	1355.71
p-xylene	1070.02
chlorobenzene	1562.57
dimethyl carbonate	589.78
n-octane	109.11
formamide	357.59
cyclopentanone	2202.55
2-pentanone	2070.61
anisole	1244.3
cyclopentyl methyl ether	2210.86
gamma-butyrolactone	1859.65
1-methoxy-2-propanol	1267.36
pyridine	2054.96
3-pentanone	1551.23
furfural	1555.47
n-dodecane	59.45
diethylene glycol	742.03
diisopropyl ether	1156.77
tert-amyl alcohol	1554.59
acetylacetone	1549.02
n-hexadecane	71.32
acetophenone	917.27
methyl propionate	1296.85
isopentyl acetate	1770.61
trichloroethylene	3820.21
n-nonanol	523.95
cyclohexanol	1709.66
benzyl alcohol	759.55
2-ethylhexanol	921.23
isooctanol	564.1
dipropyl ether	1003.11
1,2-dichlorobenzene	1285.55
ethyl lactate	346.7
propylene carbonate	1183.26
n-methylformamide	864.62
2-pentanol	1370.85
n-pentane	555.23
1-propoxy-2-propanol	1178.42
1-methoxy-2-propyl acetate	1389.55
2-(2-methoxypropoxy) propanol	661.9
mesitylene	862.41
ε-caprolactone	2036.79
p-cymene	463.12
epichlorohydrin	2617.12
1,1,1-trichloroethane	2832.68
2-aminoethanol	357.34
morpholine-4-carbaldehyde	1851.9
sulfolane	1344.35
2,2,4-trimethylpentane	259.34
2-methyltetrahydrofuran	2749.2
n-hexyl acetate	1481.66
isooctane	241.44
2-(2-butoxyethoxy)ethanol	1016.73
sec-butyl acetate	945.22
tert-butyl acetate	1730.89
decalin	341.96
glycerin	302.25
diglyme	1798.94
acrylic acid	562.78
isopropyl myristate	433.11
n-butyric acid	1592.49
acetyl acetate	1118.6
di(2-ethylhexyl) phthalate	350.43
ethyl propionate	952.49
nitromethane	1441.06
1,2-diethoxyethane	1456.57
benzonitrile	1132.44
trioctyl phosphate	250.11
1-bromopropane	1879.28
gamma-valerolactone	2538.12
n-decanol	337.19
triethyl phosphate	346.24
4-methyl-2-pentanol	943.41
propionitrile	1448.05
vinylene carbonate	1057.9
1,1,2-trichlorotrifluoroethane	1233.64
DMS	866.83
cumene	608.97
2-octanol	508.09
2-hexanone	1098.4
octyl acetate	541.65
limonene	681.21
1,2-dimethoxyethane	1802.56
ethyl orthosilicate	392.35
tributyl phosphate	335.37
diacetone alcohol	1262.23
N,N-dimethylaniline	848.92
acrylonitrile	1312.35
aniline	1291.17
1,3-propanediol	751.4
bromobenzene	1688.48
dibromomethane	2013.1
1,1,2,2-tetrachloroethane	3091.37
2-methyl-cyclohexyl acetate	723.6
tetrabutyl urea	389.45
diisobutyl methanol	483.46
2-phenylethanol	997.95
styrene	1001.09
dioctyl adipate	454.56
dimethyl sulfate	613.61
ethyl butyrate	915.28
methyl lactate	435.18
butyl lactate	583.75
diethyl carbonate	548.67
propanediol butyl ether	650.96
triethyl orthoformate	628.43
p-tert-butyltoluene	486.9
methyl 4-tert-butylbenzoate	761.97
morpholine	2884.65
tert-butylamine	1412.59
n-dodecanol	234.63
dimethoxymethane	1673.16
ethylene carbonate	1006.63
cyrene	506.9
2-ethoxyethyl acetate	1133.13
2-ethylhexyl acetate	1334.19
1,2,4-trichlorobenzene	1374.71
4-methylpyridine	2727.12
dibutyl ether	862.17
2,6-dimethyl-4-heptanol	483.46
DEF	2010.31
dimethyl isosorbide	1077.85
tetrachloroethylene	2090.73
eugenol	655.98
triacetin	764.91
span 80	581.28
1,4-butanediol	244.63
1,1-dichloroethane	2750.68
2-methyl-1-pentanol	1004.84
methyl formate	703.85
2-methyl-1-butanol	1654.37
n-decane	127.02
butyronitrile	1808.56
3,7-dimethyl-1-octanol	626.7
1-chlorooctane	523.76
1-chlorotetradecane	165.53
n-nonane	132.51
undecane	81.5
tert-butylcyclohexane	339.73
cyclooctane	326.92
cyclopentanol	1139.7
tetrahydropyran	3359.74
tert-amyl methyl ether	1887.32
2,5,8-trioxanonane	947.53
1-hexene	1291.03
2-isopropoxyethanol	733.13
2,2,2-trifluoroethanol	366.27
methyl butyrate	1176.79

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