Molecular formula
C12H22O2

SMILES
CCCCC1(CCCCC1)OC(=O)C

Fragrance
Fruity	83.23%
Floral	81.09%
Woody	62.7%
Herbal	52.56%
Sweet	52.3%
Rose	41.9%
Fresh	36.59%
Mint	34.01%
Jasmin	33.36%
Berry	30.51%

 

Flavor
Fruity	48.69%
Sweet	47.67%
Herbal	46.28%
Green	43.05%
Woody	38.89%
Fruit	37.83%
Fresh	32.67%
Earthy	32.59%
Tropical	30.48%
Rose	30.06%

 

Odor impact est.
Medium

XLogP3-AA
3.5

pKa est.
8.53 (weak base)

Molecular weight
198.3 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Moderately slow

Boiling point est.
247°C

Flash point

• 108.89 ˚C est.

• butylcyclohexyl acetate
• SCHEMBL110882

Butylcyclohexyl acetate is commonly used as a fragrance ingredient and odorant, providing green/fruit notes and acting as a fixative to extend the scent in formulations. In cosmetics and personal care, it is used in perfumes, body lotions, shampoos, and bath products as a fragrance component. In household products, it is used in air fresheners, laundry products, and other cleaning items to impart a pleasant aroma. In cleaning products, it appears in detergents and surface cleaners to enhance fragrance release. In industrial manufacturing, it may be evaluated as an intermediate in fragrance synthesis and related scent formulations.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	2123.12
methanol	2534.34
isopropanol	2552.19
water	0.38
ethyl acetate	1830.76
n-propanol	2212.07
acetone	2583.68
n-butanol	2076.23
acetonitrile	1754.55
DMF	2624.95
toluene	1682.52
isobutanol	2105.5
1,4-dioxane	2769.95
methyl acetate	1538.01
THF	4066.61
2-butanone	2226.67
n-pentanol	1360.34
sec-butanol	2377.79
n-hexane	952.56
ethylene glycol	261.25
NMP	2495.61
cyclohexane	1503.93
DMSO	2088.71
n-butyl acetate	1889.82
n-octanol	925.67
chloroform	7365.77
n-propyl acetate	1167.16
acetic acid	1149.23
dichloromethane	4878.52
cyclohexanone	4250.2
propylene glycol	543.62
isopropyl acetate	1370.97
DMAc	2011.97
2-ethoxyethanol	974.51
isopentanol	1924.71
n-heptane	368.38
ethyl formate	1182.54
1,2-dichloroethane	2877.32
n-hexanol	2018.1
2-methoxyethanol	1645.16
isobutyl acetate	887.84
tetrachloromethane	1103.95
n-pentyl acetate	1287.62
transcutol	2526.35
n-heptanol	804.75
ethylbenzene	843.84
MIBK	1288.11
2-propoxyethanol	1728.13
tert-butanol	2640.69
MTBE	2593.42
2-butoxyethanol	913.14
propionic acid	1467.33
o-xylene	910.79
formic acid	268.25
diethyl ether	2298.56
m-xylene	1001.66
p-xylene	1083.37
chlorobenzene	2134.99
dimethyl carbonate	533.06
n-octane	164.11
formamide	359.56
cyclopentanone	3445.87
2-pentanone	1943.29
anisole	1144.47
cyclopentyl methyl ether	2423.76
gamma-butyrolactone	3188.55
1-methoxy-2-propanol	1478.66
pyridine	2988.21
3-pentanone	1432.05
furfural	2163.02
n-dodecane	120.72
diethylene glycol	825.45
diisopropyl ether	805.16
tert-amyl alcohol	2303.38
acetylacetone	1567.03
n-hexadecane	143.31
acetophenone	988.31
methyl propionate	1358.88
isopentyl acetate	1662.89
trichloroethylene	4810.85
n-nonanol	750.45
cyclohexanol	2695.57
benzyl alcohol	921.98
2-ethylhexanol	1108.89
isooctanol	657.13
dipropyl ether	1202.99
1,2-dichlorobenzene	1658.28
ethyl lactate	481.36
propylene carbonate	1982.45
n-methylformamide	1194.22
2-pentanol	1681.72
n-pentane	699.53
1-propoxy-2-propanol	1375.42
1-methoxy-2-propyl acetate	1220.23
2-(2-methoxypropoxy) propanol	826.56
mesitylene	658.8
ε-caprolactone	3108.15
p-cymene	496.22
epichlorohydrin	3023.45
1,1,1-trichloroethane	3280.09
2-aminoethanol	705.96
morpholine-4-carbaldehyde	2068.6
sulfolane	3239.44
2,2,4-trimethylpentane	265.71
2-methyltetrahydrofuran	3307.61
n-hexyl acetate	1796.9
isooctane	190.38
2-(2-butoxyethoxy)ethanol	1110.5
sec-butyl acetate	889.72
tert-butyl acetate	1308.46
decalin	432.47
glycerin	533.48
diglyme	1748.32
acrylic acid	989.99
isopropyl myristate	652.44
n-butyric acid	2260.61
acetyl acetate	1044.71
di(2-ethylhexyl) phthalate	526.81
ethyl propionate	1018.72
nitromethane	1656.52
1,2-diethoxyethane	1247.43
benzonitrile	1620.49
trioctyl phosphate	422.97
1-bromopropane	2746.29
gamma-valerolactone	3256.12
n-decanol	525.84
triethyl phosphate	436.04
4-methyl-2-pentanol	849.46
propionitrile	2132.75
vinylene carbonate	1696.82
1,1,2-trichlorotrifluoroethane	1785.98
DMS	981.63
cumene	555.27
2-octanol	698.75
2-hexanone	1356.33
octyl acetate	799.26
limonene	864.94
1,2-dimethoxyethane	2086.13
ethyl orthosilicate	433.94
tributyl phosphate	536.24
diacetone alcohol	1179.35
N,N-dimethylaniline	769.78
acrylonitrile	1923.35
aniline	1557.28
1,3-propanediol	987.7
bromobenzene	2493.25
dibromomethane	4064.53
1,1,2,2-tetrachloroethane	4529.96
2-methyl-cyclohexyl acetate	866.94
tetrabutyl urea	659.29
diisobutyl methanol	566.86
2-phenylethanol	1005.64
styrene	1092.53
dioctyl adipate	800.26
dimethyl sulfate	773.92
ethyl butyrate	985.93
methyl lactate	588.35
butyl lactate	849.34
diethyl carbonate	639.47
propanediol butyl ether	947.23
triethyl orthoformate	679.06
p-tert-butyltoluene	482.51
methyl 4-tert-butylbenzoate	898.41
morpholine	3220.72
tert-butylamine	2011.76
n-dodecanol	397.09
dimethoxymethane	1500.23
ethylene carbonate	1651.97
cyrene	651.31
2-ethoxyethyl acetate	1065.7
2-ethylhexyl acetate	1283.41
1,2,4-trichlorobenzene	1855.56
4-methylpyridine	2960.12
dibutyl ether	1206.68
2,6-dimethyl-4-heptanol	566.86
DEF	1964.34
dimethyl isosorbide	1237.01
tetrachloroethylene	2826.62
eugenol	762.75
triacetin	1080.57
span 80	945.57
1,4-butanediol	440.88
1,1-dichloroethane	3834.51
2-methyl-1-pentanol	1209.18
methyl formate	875.61
2-methyl-1-butanol	1878.82
n-decane	222.02
butyronitrile	2362.82
3,7-dimethyl-1-octanol	861.53
1-chlorooctane	842.31
1-chlorotetradecane	299.01
n-nonane	243.87
undecane	156.12
tert-butylcyclohexane	355.18
cyclooctane	409.68
cyclopentanol	2535.71
tetrahydropyran	4182.74
tert-amyl methyl ether	1680.27
2,5,8-trioxanonane	1118.85
1-hexene	2069.23
2-isopropoxyethanol	802.9
2,2,2-trifluoroethanol	352.85
methyl butyrate	1498.95

Scent© AI