Molecular formula
C15H24O

SMILES
CCC(=O)/C(=C/C1C(CC=CC1(C)C)C)/C

Fragrance
Woody	86.56%
Violet	54.96%
Floral	50.82%
Orris	50.03%
Powdery	49.97%
Amber	47.02%
Sandalwood	45.85%
Dry	45.01%
Musk	39.51%
Vetiver	38.5%

 

Flavor
Woody	61.27%
Herbal	45.18%
Floral	38.18%
Sweet	34.61%
Spicy	32.21%
Wood	30.27%
Herb	29.15%
Minty	26.28%
Tropical	25.91%
Violet	25.31%

 

Odor impact est.
Medium

XLogP3-AA
4.1

pKa est.
8.92 (weak base)

Molecular weight
220.35 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Slow

Boiling point est.
266°C

Flash point

• 120.62 ˚C est.

• SCHEMBL3504021
• SCHEMBL3722064
• 2-Methyl-1-(2,2,6-trimethylcyclohexen-1-yl)pent-1-en-3-one

2-Methyl-1-(2,2,6-trimethylcyclohexen-1-yl)pent-1-en-3-one is typically regarded as a fragrance ingredient in perfumery, acting as an odorant and occasionally as a fixative; it may be used in cosmetics and personal care formulations to impart fragrance; in household products and cleaners it is evaluated as an odorant additive; in coatings and inks it may function as a fragrance additive or odor-control component; and it is occasionally evaluated as an intermediate in the synthesis of fragrant compounds for polymers and plastics.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	840.56
methanol	514.8
isopropanol	961.2
water	0.34
ethyl acetate	1815.38
n-propanol	846.33
acetone	1440.72
n-butanol	969.93
acetonitrile	1028.99
DMF	1602.93
toluene	1721.21
isobutanol	796.6
1,4-dioxane	2096.03
methyl acetate	1163.94
THF	3034.38
2-butanone	1558.76
n-pentanol	513.85
sec-butanol	805.48
n-hexane	319.46
ethylene glycol	46.81
NMP	1319.05
cyclohexane	609.41
DMSO	537.32
n-butyl acetate	1433.39
n-octanol	387.48
chloroform	3217.24
n-propyl acetate	802.93
acetic acid	427.78
dichloromethane	2775.39
cyclohexanone	2193.29
propylene glycol	108.5
isopropyl acetate	1335.74
DMAc	1253.99
2-ethoxyethanol	476.49
isopentanol	983.2
n-heptane	148.67
ethyl formate	604.72
1,2-dichloroethane	1891.38
n-hexanol	1011.27
2-methoxyethanol	788.56
isobutyl acetate	615.18
tetrachloromethane	656.52
n-pentyl acetate	701.93
transcutol	2533.52
n-heptanol	406.35
ethylbenzene	701.2
MIBK	1027.99
2-propoxyethanol	1078.01
tert-butanol	1237.67
MTBE	2083.73
2-butoxyethanol	602.63
propionic acid	436.4
o-xylene	831.44
formic acid	80.35
diethyl ether	2146.05
m-xylene	1089.45
p-xylene	821.1
chlorobenzene	1386.03
dimethyl carbonate	425.36
n-octane	64.38
formamide	160.35
cyclopentanone	1963.87
2-pentanone	1627.37
anisole	976.95
cyclopentyl methyl ether	1759.55
gamma-butyrolactone	1678.24
1-methoxy-2-propanol	842.46
pyridine	1770.06
3-pentanone	1212.62
furfural	1177.24
n-dodecane	38.56
diethylene glycol	422.52
diisopropyl ether	735.28
tert-amyl alcohol	945.6
acetylacetone	1303.1
n-hexadecane	47.2
acetophenone	761.29
methyl propionate	1047.27
isopentyl acetate	1337.36
trichloroethylene	3210.67
n-nonanol	347.54
cyclohexanol	1081.51
benzyl alcohol	555.86
2-ethylhexanol	605.54
isooctanol	358.0
dipropyl ether	798.49
1,2-dichlorobenzene	1126.35
ethyl lactate	247.42
propylene carbonate	977.42
n-methylformamide	467.44
2-pentanol	847.85
n-pentane	306.35
1-propoxy-2-propanol	872.46
1-methoxy-2-propyl acetate	1131.88
2-(2-methoxypropoxy) propanol	543.01
mesitylene	664.53
ε-caprolactone	1628.63
p-cymene	374.78
epichlorohydrin	2238.6
1,1,1-trichloroethane	2139.59
2-aminoethanol	164.5
morpholine-4-carbaldehyde	1418.29
sulfolane	1283.88
2,2,4-trimethylpentane	143.36
2-methyltetrahydrofuran	2477.97
n-hexyl acetate	1037.3
isooctane	129.89
2-(2-butoxyethoxy)ethanol	779.47
sec-butyl acetate	738.38
tert-butyl acetate	1276.89
decalin	219.11
glycerin	138.65
diglyme	1412.28
acrylic acid	306.13
isopropyl myristate	354.06
n-butyric acid	957.35
acetyl acetate	834.92
di(2-ethylhexyl) phthalate	292.71
ethyl propionate	784.86
nitromethane	807.64
1,2-diethoxyethane	1251.84
benzonitrile	899.16
trioctyl phosphate	209.24
1-bromopropane	1576.16
gamma-valerolactone	2026.06
n-decanol	232.44
triethyl phosphate	295.13
4-methyl-2-pentanol	530.88
propionitrile	1044.99
vinylene carbonate	886.17
1,1,2-trichlorotrifluoroethane	816.05
DMS	710.05
cumene	431.75
2-octanol	309.86
2-hexanone	821.25
octyl acetate	423.94
limonene	549.91
1,2-dimethoxyethane	1159.71
ethyl orthosilicate	315.87
tributyl phosphate	270.55
diacetone alcohol	844.92
N,N-dimethylaniline	615.92
acrylonitrile	909.4
aniline	1087.38
1,3-propanediol	365.73
bromobenzene	1620.31
dibromomethane	1977.2
1,1,2,2-tetrachloroethane	2447.78
2-methyl-cyclohexyl acetate	614.94
tetrabutyl urea	315.56
diisobutyl methanol	348.11
2-phenylethanol	737.16
styrene	810.78
dioctyl adipate	417.33
dimethyl sulfate	488.3
ethyl butyrate	806.81
methyl lactate	294.36
butyl lactate	417.89
diethyl carbonate	474.35
propanediol butyl ether	446.17
triethyl orthoformate	521.08
p-tert-butyltoluene	383.41
methyl 4-tert-butylbenzoate	630.66
morpholine	2271.78
tert-butylamine	992.79
n-dodecanol	163.85
dimethoxymethane	1254.75
ethylene carbonate	792.79
cyrene	431.6
2-ethoxyethyl acetate	896.74
2-ethylhexyl acetate	1036.97
1,2,4-trichlorobenzene	1206.89
4-methylpyridine	2240.31
dibutyl ether	640.08
2,6-dimethyl-4-heptanol	348.11
DEF	1492.51
dimethyl isosorbide	978.82
tetrachloroethylene	1549.58
eugenol	512.44
triacetin	655.9
span 80	479.82
1,4-butanediol	119.44
1,1-dichloroethane	2253.15
2-methyl-1-pentanol	560.16
methyl formate	359.84
2-methyl-1-butanol	908.37
n-decane	77.11
butyronitrile	1307.84
3,7-dimethyl-1-octanol	422.28
1-chlorooctane	365.92
1-chlorotetradecane	122.35
n-nonane	78.63
undecane	52.24
tert-butylcyclohexane	193.79
cyclooctane	198.95
cyclopentanol	818.82
tetrahydropyran	2827.6
tert-amyl methyl ether	1204.01
2,5,8-trioxanonane	781.81
1-hexene	804.5
2-isopropoxyethanol	453.39
2,2,2-trifluoroethanol	154.97
methyl butyrate	957.12

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