Molecular formula
C16H34O2

SMILES
CCCCCC(OCCCCC)OCCCCC

Fragrance
Green	96.12%
Cognac	68.39%
Oily	62.41%
Alcoholic	61.33%
Apple	61.11%
Fermented	50.04%
Vegetable	38.95%
Ethereal	38.87%
Cocoa	34.29%
Herbal	32.79%

 

Flavor
Green	56.34%
Fruity	51.34%
Herbal	43.48%
Floral	38.62%
Mushroom	37.58%
Earthy	33.11%
Fatty	33.06%
Waxy	30.51%
Oily	29.84%
Sweet	29.18%

 

Odor impact est.
Medium

XLogP3-AA
6.0

pKa est.
6.87 (neutral)

Molecular weight
258.44 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
288°C

Flash point

• 120.35 ˚C est.

• hexanal dipentyl acetal
• SCHEMBL7528798
• Q63409810

Hexanal dipentyl acetal is used as a fragrance ingredient with fixative properties, commonly employed in perfumery and cosmetics to extend and stabilize scent notes. It may also serve as a solvent or processing aid in industrial manufacturing and as an intermediate for polymers, where it can function as a plasticizer or as an additive to coatings and paints. In coatings/inks applications and in household formulations such as cleaners and detergents, it can act as a solvent and fragrance component, contributing to odor profiles and formulation stability. The exact role depends on the formulation and local regulatory limits.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	8138.53
methanol	4949.04
isopropanol	9437.33
water	0.34
ethyl acetate	26343.64
n-propanol	9216.49
acetone	20480.44
n-butanol	11832.52
acetonitrile	11267.76
DMF	11125.11
toluene	13134.55
isobutanol	9516.32
1,4-dioxane	19872.86
methyl acetate	13288.93
THF	25616.5
2-butanone	18712.67
n-pentanol	7744.45
sec-butanol	11405.29
n-hexane	15159.34
ethylene glycol	360.48
NMP	13723.21
cyclohexane	34594.53
DMSO	12252.44
n-butyl acetate	30877.43
n-octanol	6492.44
chloroform	38705.91
n-propyl acetate	20782.98
acetic acid	7224.89
dichloromethane	39686.19
cyclohexanone	38191.01
propylene glycol	840.18
isopropyl acetate	21230.88
DMAc	11249.97
2-ethoxyethanol	6330.07
isopentanol	13188.62
n-heptane	12678.08
ethyl formate	9426.35
1,2-dichloroethane	31210.66
n-hexanol	10372.14
2-methoxyethanol	7566.62
isobutyl acetate	12760.92
tetrachloromethane	12052.06
n-pentyl acetate	19546.72
transcutol	20727.32
n-heptanol	6064.78
ethylbenzene	8275.81
MIBK	14104.6
2-propoxyethanol	9246.5
tert-butanol	13744.12
MTBE	25457.56
2-butoxyethanol	7378.88
propionic acid	7118.54
o-xylene	8422.88
formic acid	820.64
diethyl ether	28930.18
m-xylene	7878.76
p-xylene	11783.65
chlorobenzene	15780.41
dimethyl carbonate	3383.32
n-octane	3871.93
formamide	1617.48
cyclopentanone	24198.75
2-pentanone	22514.68
anisole	8892.04
cyclopentyl methyl ether	24385.83
gamma-butyrolactone	20222.64
1-methoxy-2-propanol	7727.56
pyridine	22389.84
3-pentanone	17348.02
furfural	12988.34
n-dodecane	1592.23
diethylene glycol	2683.83
diisopropyl ether	13410.27
tert-amyl alcohol	14259.56
acetylacetone	17288.58
n-hexadecane	1960.38
acetophenone	9170.55
methyl propionate	12926.69
isopentyl acetate	25550.6
trichloroethylene	40611.92
n-nonanol	5889.32
cyclohexanol	20397.52
benzyl alcohol	5135.37
2-ethylhexanol	11852.72
isooctanol	6027.45
dipropyl ether	23926.13
1,2-dichlorobenzene	14179.3
ethyl lactate	3836.49
propylene carbonate	13290.68
n-methylformamide	5085.14
2-pentanol	12402.08
n-pentane	10888.96
1-propoxy-2-propanol	11723.24
1-methoxy-2-propyl acetate	12747.17
2-(2-methoxypropoxy) propanol	4528.58
mesitylene	6163.98
ε-caprolactone	28380.33
p-cymene	6652.18
epichlorohydrin	22827.6
1,1,1-trichloroethane	35295.95
2-aminoethanol	1405.23
morpholine-4-carbaldehyde	11682.63
sulfolane	18549.17
2,2,4-trimethylpentane	4221.18
2-methyltetrahydrofuran	30881.86
n-hexyl acetate	19697.81
isooctane	3179.69
2-(2-butoxyethoxy)ethanol	6579.71
sec-butyl acetate	16753.63
tert-butyl acetate	19928.42
decalin	7880.06
glycerin	941.99
diglyme	16254.2
acrylic acid	4189.13
isopropyl myristate	6470.94
n-butyric acid	18305.28
acetyl acetate	13854.97
di(2-ethylhexyl) phthalate	3127.52
ethyl propionate	18026.9
nitromethane	12591.7
1,2-diethoxyethane	21920.9
benzonitrile	11012.09
trioctyl phosphate	2986.73
1-bromopropane	29081.92
gamma-valerolactone	23815.95
n-decanol	3729.33
triethyl phosphate	6076.93
4-methyl-2-pentanol	7155.92
propionitrile	12228.74
vinylene carbonate	10477.62
1,1,2-trichlorotrifluoroethane	11412.47
DMS	7669.75
cumene	5469.98
2-octanol	6014.21
2-hexanone	17004.59
octyl acetate	7078.1
limonene	13728.5
1,2-dimethoxyethane	18262.91
ethyl orthosilicate	7045.55
tributyl phosphate	4507.38
diacetone alcohol	10137.09
N,N-dimethylaniline	6551.3
acrylonitrile	9443.29
aniline	9308.4
1,3-propanediol	3542.12
bromobenzene	20233.49
dibromomethane	32235.46
1,1,2,2-tetrachloroethane	37119.2
2-methyl-cyclohexyl acetate	11234.86
tetrabutyl urea	5734.09
diisobutyl methanol	7726.31
2-phenylethanol	5594.1
styrene	10469.36
dioctyl adipate	7084.57
dimethyl sulfate	4269.56
ethyl butyrate	23411.4
methyl lactate	3003.94
butyl lactate	8068.98
diethyl carbonate	10884.56
propanediol butyl ether	4380.98
triethyl orthoformate	13962.44
p-tert-butyltoluene	5929.62
methyl 4-tert-butylbenzoate	6372.67
morpholine	23281.65
tert-butylamine	12867.97
n-dodecanol	2809.56
dimethoxymethane	9262.71
ethylene carbonate	12282.19
cyrene	3032.97
2-ethoxyethyl acetate	14304.06
2-ethylhexyl acetate	21636.48
1,2,4-trichlorobenzene	13462.78
4-methylpyridine	24180.65
dibutyl ether	23594.08
2,6-dimethyl-4-heptanol	7726.31
DEF	21990.7
dimethyl isosorbide	7572.75
tetrachloroethylene	25838.0
eugenol	4661.06
triacetin	9217.21
span 80	5223.08
1,4-butanediol	1455.48
1,1-dichloroethane	31545.72
2-methyl-1-pentanol	8414.8
methyl formate	3720.16
2-methyl-1-butanol	11793.27
n-decane	3670.18
butyronitrile	17670.52
3,7-dimethyl-1-octanol	7824.62
1-chlorooctane	10064.87
1-chlorotetradecane	3058.52
n-nonane	4271.82
undecane	2181.3
tert-butylcyclohexane	6036.52
cyclooctane	9012.19
cyclopentanol	13018.32
tetrahydropyran	42051.56
tert-amyl methyl ether	17955.2
2,5,8-trioxanonane	7102.93
1-hexene	22183.44
2-isopropoxyethanol	5990.77
2,2,2-trifluoroethanol	2160.83
methyl butyrate	24551.92

Scent© AI