Molecular formula
C13H24O2

SMILES
CC(C)(CCCC1CCC(CC1)C=O)O

Fragrance
Floral	90.97%
Muguet	62.26%
Lily	61.56%
Fresh	58.07%
Rose	49.24%
Woody	45.22%
Green	43.85%
Clean	43.58%
Aldehydic	43.41%
Citrus	42.73%

 

Flavor
Green	67.94%
Floral	55.84%
Waxy	42.69%
Rose	42.08%
Sweet	40.27%
Fresh	38.24%
Herbal	37.24%
Fruity	32.1%
Tropical	31.54%
Oily	29.76%

 

Odor impact est.
Medium

XLogP3-AA
2.7

pKa est.
8.44 (weak base)

Molecular weight
212.33 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
309°C

Flash point

• 136.64 ˚C est.

• SCHEMBL6231153

4-(4-Hydroxy-4-methylpentyl)cyclohexane-1-carbaldehyde is primarily used as a fragrance ingredient and as an intermediate in the synthesis of aroma compounds in the perfume and cosmetics sectors; it can function as an odorant and, due to its relatively low volatility, as a fragrance fixative in certain formulations. It is also employed in household and cleaning products as a fragrance additive for detergents, dishwashing liquids, and surface cleaners. In industrial manufacturing, it serves as an intermediate for preparing more complex fragrance molecules for coatings, paints, and inks, as well as scent-enabled adhesives and packaging formulations.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	2242.05
methanol	2096.81
isopropanol	1935.5
water	0.43
ethyl acetate	1538.82
n-propanol	1500.51
acetone	1672.89
n-butanol	1419.86
acetonitrile	820.18
DMF	899.3
toluene	357.7
isobutanol	873.31
1,4-dioxane	1806.28
methyl acetate	901.09
THF	2804.21
2-butanone	1080.12
n-pentanol	709.67
sec-butanol	922.83
n-hexane	158.18
ethylene glycol	134.55
NMP	415.2
cyclohexane	189.27
DMSO	981.29
n-butyl acetate	955.54
n-octanol	266.42
chloroform	1560.27
n-propyl acetate	790.36
acetic acid	740.98
dichloromethane	1060.13
cyclohexanone	1078.26
propylene glycol	354.32
isopropyl acetate	1103.18
DMAc	595.39
2-ethoxyethanol	928.0
isopentanol	1066.56
n-heptane	76.24
ethyl formate	570.36
1,2-dichloroethane	817.93
n-hexanol	853.83
2-methoxyethanol	1627.19
isobutyl acetate	556.19
tetrachloromethane	233.24
n-pentyl acetate	378.94
transcutol	3366.58
n-heptanol	295.41
ethylbenzene	173.2
MIBK	736.84
2-propoxyethanol	1359.25
tert-butanol	1881.97
MTBE	1668.74
2-butoxyethanol	605.31
propionic acid	639.39
o-xylene	197.45
formic acid	217.48
diethyl ether	1686.11
m-xylene	274.81
p-xylene	210.08
chlorobenzene	389.67
dimethyl carbonate	208.15
n-octane	26.57
formamide	305.57
cyclopentanone	1070.02
2-pentanone	1128.04
anisole	411.34
cyclopentyl methyl ether	1003.84
gamma-butyrolactone	1118.24
1-methoxy-2-propanol	1418.91
pyridine	787.97
3-pentanone	604.95
furfural	716.86
n-dodecane	17.08
diethylene glycol	710.38
diisopropyl ether	500.98
tert-amyl alcohol	893.57
acetylacetone	966.42
n-hexadecane	20.11
acetophenone	318.0
methyl propionate	784.52
isopentyl acetate	814.72
trichloroethylene	1253.41
n-nonanol	232.15
cyclohexanol	769.24
benzyl alcohol	314.3
2-ethylhexanol	395.16
isooctanol	246.36
dipropyl ether	706.53
1,2-dichlorobenzene	326.45
ethyl lactate	280.03
propylene carbonate	664.0
n-methylformamide	599.53
2-pentanol	861.42
n-pentane	127.16
1-propoxy-2-propanol	1061.99
1-methoxy-2-propyl acetate	967.61
2-(2-methoxypropoxy) propanol	500.34
mesitylene	190.24
ε-caprolactone	945.81
p-cymene	125.9
epichlorohydrin	1290.6
1,1,1-trichloroethane	822.54
2-aminoethanol	506.97
morpholine-4-carbaldehyde	864.2
sulfolane	836.67
2,2,4-trimethylpentane	57.72
2-methyltetrahydrofuran	1537.48
n-hexyl acetate	532.3
isooctane	65.04
2-(2-butoxyethoxy)ethanol	871.68
sec-butyl acetate	585.05
tert-butyl acetate	998.88
decalin	71.57
glycerin	383.4
diglyme	1459.73
acrylic acid	367.12
isopropyl myristate	195.26
n-butyric acid	1320.2
acetyl acetate	614.47
di(2-ethylhexyl) phthalate	166.12
ethyl propionate	612.06
nitromethane	918.95
1,2-diethoxyethane	1175.92
benzonitrile	383.19
trioctyl phosphate	125.27
1-bromopropane	663.26
gamma-valerolactone	1485.42
n-decanol	167.92
triethyl phosphate	195.63
4-methyl-2-pentanol	519.04
propionitrile	730.82
vinylene carbonate	535.88
1,1,2-trichlorotrifluoroethane	751.79
DMS	346.05
cumene	132.93
2-octanol	179.52
2-hexanone	710.03
octyl acetate	225.84
limonene	205.3
1,2-dimethoxyethane	1481.23
ethyl orthosilicate	216.17
tributyl phosphate	180.24
diacetone alcohol	862.52
N,N-dimethylaniline	231.3
acrylonitrile	573.91
aniline	502.2
1,3-propanediol	908.35
bromobenzene	387.18
dibromomethane	796.89
1,1,2,2-tetrachloroethane	1132.25
2-methyl-cyclohexyl acetate	371.37
tetrabutyl urea	185.62
diisobutyl methanol	266.12
2-phenylethanol	394.12
styrene	210.86
dioctyl adipate	263.1
dimethyl sulfate	236.65
ethyl butyrate	595.23
methyl lactate	328.23
butyl lactate	343.13
diethyl carbonate	330.66
propanediol butyl ether	528.59
triethyl orthoformate	407.27
p-tert-butyltoluene	137.73
methyl 4-tert-butylbenzoate	329.81
morpholine	2159.3
tert-butylamine	1198.56
n-dodecanol	119.04
dimethoxymethane	1064.9
ethylene carbonate	548.46
cyrene	305.73
2-ethoxyethyl acetate	540.38
2-ethylhexyl acetate	576.68
1,2,4-trichlorobenzene	377.13
4-methylpyridine	736.04
dibutyl ether	492.09
2,6-dimethyl-4-heptanol	266.12
DEF	762.63
dimethyl isosorbide	714.13
tetrachloroethylene	728.25
eugenol	291.39
triacetin	469.7
span 80	438.67
1,4-butanediol	267.58
1,1-dichloroethane	1035.31
2-methyl-1-pentanol	508.28
methyl formate	361.04
2-methyl-1-butanol	725.58
n-decane	37.17
butyronitrile	979.15
3,7-dimethyl-1-octanol	309.58
1-chlorooctane	164.97
1-chlorotetradecane	54.69
n-nonane	37.45
undecane	23.73
tert-butylcyclohexane	77.31
cyclooctane	60.76
cyclopentanol	706.57
tetrahydropyran	1961.39
tert-amyl methyl ether	759.13
2,5,8-trioxanonane	844.79
1-hexene	528.8
2-isopropoxyethanol	710.08
2,2,2-trifluoroethanol	180.99
methyl butyrate	756.12

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