Molecular formula
C12H20O2

SMILES
CC1CCC(CC1C(=O)OC)C(=C)C

Fragrance
Fruity	82.61%
Herbal	69.6%
Green	61.49%
Floral	61.38%
Sweet	54.76%
Mint	53.5%
Woody	52.91%
Spicy	48.55%
Fresh	46.35%
Rose	41.92%

 

Flavor
Fruity	44.43%
Minty	43.85%
Herbal	42.72%
Floral	39.22%
Mint	36.33%
Fresh	35.38%
Tropical	35.03%
Green	29.12%
Herb	28.59%
Sweet	28.52%

 

Odor impact est.
Medium

XLogP3-AA
3.6

pKa est.
8.19 (weak base)

Molecular weight
196.29 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Moderately slow

Boiling point est.
240°C

Flash point

• 99.48 ˚C est.

methyl 2-methyl-5-prop-1-en-2-ylcyclohexane-1-carboxylate is typically used as a fragrance ingredient and aroma chemical in perfumery; it may be evaluated as a potential fixative in fragrance formulations; it can serve as an intermediate in the synthesis of more complex scent compounds; it is used in cosmetics/personal care formulations as part of fragrance systems; it finds application in household products such as air fresheners and cleaners to impart a specific aroma; and in industrial manufacturing it can function as an intermediate for the development of specialty fragrance chemicals, including use in coatings and inks as a scent additive.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	3416.78
methanol	2990.02
isopropanol	4087.33
water	1.42
ethyl acetate	2137.36
n-propanol	2807.28
acetone	2100.66
n-butanol	2372.9
acetonitrile	2332.51
DMF	1859.55
toluene	895.16
isobutanol	1969.63
1,4-dioxane	4118.64
methyl acetate	1590.88
THF	3590.31
2-butanone	1697.02
n-pentanol	1017.74
sec-butanol	2163.6
n-hexane	39.69
ethylene glycol	228.54
NMP	998.16
cyclohexane	171.08
DMSO	1111.02
n-butyl acetate	1049.73
n-octanol	318.42
chloroform	5060.65
n-propyl acetate	835.18
acetic acid	1590.2
dichloromethane	3955.35
cyclohexanone	2206.45
propylene glycol	454.84
isopropyl acetate	1220.65
DMAc	939.75
2-ethoxyethanol	1076.41
isopentanol	1757.01
n-heptane	25.27
ethyl formate	1329.93
1,2-dichloroethane	2127.66
n-hexanol	1115.48
2-methoxyethanol	2387.39
isobutyl acetate	482.26
tetrachloromethane	551.76
n-pentyl acetate	495.86
transcutol	3090.15
n-heptanol	363.1
ethylbenzene	346.19
MIBK	785.18
2-propoxyethanol	1415.06
tert-butanol	3399.54
MTBE	2133.99
2-butoxyethanol	671.25
propionic acid	1137.88
o-xylene	443.08
formic acid	445.31
diethyl ether	1920.18
m-xylene	543.18
p-xylene	468.21
chlorobenzene	1123.77
dimethyl carbonate	326.65
n-octane	13.22
formamide	712.64
cyclopentanone	2003.05
2-pentanone	1358.36
anisole	730.18
cyclopentyl methyl ether	1198.69
gamma-butyrolactone	2190.35
1-methoxy-2-propanol	1845.41
pyridine	2412.49
3-pentanone	739.61
furfural	1676.26
n-dodecane	12.28
diethylene glycol	867.04
diisopropyl ether	376.23
tert-amyl alcohol	1823.33
acetylacetone	1239.68
n-hexadecane	15.28
acetophenone	524.7
methyl propionate	965.92
isopentyl acetate	973.15
trichloroethylene	3891.64
n-nonanol	260.84
cyclohexanol	1585.38
benzyl alcohol	667.73
2-ethylhexanol	414.91
isooctanol	295.6
dipropyl ether	395.76
1,2-dichlorobenzene	776.61
ethyl lactate	277.2
propylene carbonate	1173.14
n-methylformamide	1152.47
2-pentanol	1404.45
n-pentane	62.84
1-propoxy-2-propanol	975.5
1-methoxy-2-propyl acetate	849.45
2-(2-methoxypropoxy) propanol	480.85
mesitylene	310.15
ε-caprolactone	1734.43
p-cymene	181.56
epichlorohydrin	2889.76
1,1,1-trichloroethane	2180.09
2-aminoethanol	735.73
morpholine-4-carbaldehyde	1514.08
sulfolane	1339.49
2,2,4-trimethylpentane	47.8
2-methyltetrahydrofuran	2690.2
n-hexyl acetate	661.14
isooctane	43.15
2-(2-butoxyethoxy)ethanol	809.94
sec-butyl acetate	566.66
tert-butyl acetate	980.89
decalin	61.14
glycerin	496.99
diglyme	1541.05
acrylic acid	734.67
isopropyl myristate	201.0
n-butyric acid	2245.82
acetyl acetate	950.93
di(2-ethylhexyl) phthalate	211.87
ethyl propionate	619.42
nitromethane	2167.09
1,2-diethoxyethane	955.57
benzonitrile	1022.93
trioctyl phosphate	143.62
1-bromopropane	1242.61
gamma-valerolactone	2518.89
n-decanol	172.65
triethyl phosphate	187.5
4-methyl-2-pentanol	631.27
propionitrile	1764.02
vinylene carbonate	1103.25
1,1,2-trichlorotrifluoroethane	1254.93
DMS	441.41
cumene	214.18
2-octanol	256.21
2-hexanone	728.74
octyl acetate	257.38
limonene	274.16
1,2-dimethoxyethane	1763.82
ethyl orthosilicate	192.22
tributyl phosphate	185.55
diacetone alcohol	982.72
N,N-dimethylaniline	362.03
acrylonitrile	1603.96
aniline	1283.93
1,3-propanediol	1534.38
bromobenzene	1129.3
dibromomethane	2408.35
1,1,2,2-tetrachloroethane	2806.03
2-methyl-cyclohexyl acetate	379.32
tetrabutyl urea	203.76
diisobutyl methanol	258.9
2-phenylethanol	643.76
styrene	458.57
dioctyl adipate	272.13
dimethyl sulfate	376.22
ethyl butyrate	595.26
methyl lactate	404.68
butyl lactate	350.07
diethyl carbonate	361.12
propanediol butyl ether	611.83
triethyl orthoformate	352.08
p-tert-butyltoluene	184.47
methyl 4-tert-butylbenzoate	427.03
morpholine	4787.09
tert-butylamine	1755.04
n-dodecanol	120.61
dimethoxymethane	1178.94
ethylene carbonate	1021.18
cyrene	419.88
2-ethoxyethyl acetate	698.4
2-ethylhexyl acetate	603.3
1,2,4-trichlorobenzene	895.51
4-methylpyridine	2269.98
dibutyl ether	361.1
2,6-dimethyl-4-heptanol	258.9
DEF	1159.81
dimethyl isosorbide	797.74
tetrachloroethylene	1723.01
eugenol	426.18
triacetin	484.37
span 80	446.33
1,4-butanediol	386.12
1,1-dichloroethane	2848.17
2-methyl-1-pentanol	802.82
methyl formate	819.21
2-methyl-1-butanol	1417.65
n-decane	22.86
butyronitrile	2083.87
3,7-dimethyl-1-octanol	335.45
1-chlorooctane	170.68
1-chlorotetradecane	54.56
n-nonane	20.29
undecane	16.08
tert-butylcyclohexane	57.76
cyclooctane	34.18
cyclopentanol	1567.67
tetrahydropyran	3760.7
tert-amyl methyl ether	847.68
2,5,8-trioxanonane	802.84
1-hexene	280.56
2-isopropoxyethanol	693.85
2,2,2-trifluoroethanol	420.12
methyl butyrate	920.06

Scent© AI