Molecular formula
C14H30O2

SMILES
CCCCCC(OCC(C)C)OCC(C)C

Fragrance
Green	97.02%
Alcoholic	70.83%
Cognac	65.94%
Fermented	61.83%
Apple	52.75%
Oily	51.01%
Cocoa	49.49%
Ethereal	48.81%
Malty	45.51%
Vegetable	32.05%

 

Flavor
Green	59.34%
Fruity	55.84%
Tropical	31.89%
Herbal	30.43%
Oily	28.02%
Earthy	27.27%
Floral	26.85%
Mushroom	24.77%
Ethereal	23.65%
Vegetable	22.84%

 

Odor impact est.
Medium

XLogP3-AA
5.1

pKa est.
7.96 (neutral)

Molecular weight
230.39 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Moderately slow

Boiling point est.
233°C

Flash point

• 87.32 ˚C est.

• SCHEMBL14778484

1,1-Bis(2-methylpropoxy)hexane is a dialkyl ether featuring two 2-methylpropoxy groups on a hexane backbone, used primarily as a solvent and processing aid in coatings, inks, and industrial cleaning formulations; it can also function as a plasticizer or co-plasticizer for polymer systems such as PVC or polyurethane; it serves as an intermediate in organic synthesis for the production of other ethers and esters; it may be employed as a co-solvent or formulation component in industrial products and adhesives; it may be evaluated as a processing solvent in manufacturing formulations.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	3307.65
methanol	2186.34
isopropanol	3548.25
water	0.87
ethyl acetate	5259.99
n-propanol	3036.52
acetone	4023.57
n-butanol	3916.31
acetonitrile	2483.2
DMF	2460.19
toluene	2953.88
isobutanol	3330.03
1,4-dioxane	5269.63
methyl acetate	3032.89
THF	6493.26
2-butanone	3795.08
n-pentanol	3251.63
sec-butanol	4021.38
n-hexane	4557.06
ethylene glycol	243.14
NMP	2701.22
cyclohexane	6457.7
DMSO	2462.69
n-butyl acetate	8843.61
n-octanol	3190.61
chloroform	12179.52
n-propyl acetate	4779.77
acetic acid	3084.42
dichloromethane	9346.41
cyclohexanone	7034.14
propylene glycol	560.62
isopropyl acetate	4746.93
DMAc	2644.95
2-ethoxyethanol	2736.38
isopentanol	4714.43
n-heptane	4495.23
ethyl formate	2726.32
1,2-dichloroethane	5798.04
n-hexanol	5282.56
2-methoxyethanol	2952.24
isobutyl acetate	3703.01
tetrachloromethane	3539.7
n-pentyl acetate	5309.47
transcutol	7732.83
n-heptanol	3119.92
ethylbenzene	2574.05
MIBK	3320.27
2-propoxyethanol	4149.7
tert-butanol	5347.38
MTBE	6540.06
2-butoxyethanol	3548.74
propionic acid	2246.49
o-xylene	2302.3
formic acid	454.29
diethyl ether	5443.57
m-xylene	2275.33
p-xylene	4060.62
chlorobenzene	3564.05
dimethyl carbonate	861.5
n-octane	1632.34
formamide	533.79
cyclopentanone	4499.56
2-pentanone	4246.53
anisole	2592.44
cyclopentyl methyl ether	4907.75
gamma-butyrolactone	4176.8
1-methoxy-2-propanol	2792.69
pyridine	4097.09
3-pentanone	2915.89
furfural	3467.5
n-dodecane	825.48
diethylene glycol	1548.2
diisopropyl ether	3232.8
tert-amyl alcohol	5283.43
acetylacetone	3865.1
n-hexadecane	950.25
acetophenone	2689.09
methyl propionate	2531.61
isopentyl acetate	8161.08
trichloroethylene	9505.8
n-nonanol	2870.86
cyclohexanol	5539.42
benzyl alcohol	1942.9
2-ethylhexanol	5338.57
isooctanol	2996.88
dipropyl ether	6071.28
1,2-dichlorobenzene	3381.24
ethyl lactate	1365.35
propylene carbonate	3485.33
n-methylformamide	1248.69
2-pentanol	4092.46
n-pentane	2790.13
1-propoxy-2-propanol	4725.22
1-methoxy-2-propyl acetate	4013.62
2-(2-methoxypropoxy) propanol	2253.84
mesitylene	1861.89
ε-caprolactone	6273.68
p-cymene	2604.79
epichlorohydrin	5251.91
1,1,1-trichloroethane	8590.8
2-aminoethanol	719.03
morpholine-4-carbaldehyde	3077.78
sulfolane	3826.96
2,2,4-trimethylpentane	1489.56
2-methyltetrahydrofuran	6717.55
n-hexyl acetate	6041.65
isooctane	1216.58
2-(2-butoxyethoxy)ethanol	3129.77
sec-butyl acetate	4185.56
tert-butyl acetate	4651.06
decalin	2455.83
glycerin	618.26
diglyme	6062.49
acrylic acid	1421.27
isopropyl myristate	2413.31
n-butyric acid	5626.63
acetyl acetate	3338.49
di(2-ethylhexyl) phthalate	1394.86
ethyl propionate	3778.17
nitromethane	3069.3
1,2-diethoxyethane	5567.11
benzonitrile	3316.23
trioctyl phosphate	1356.38
1-bromopropane	5883.69
gamma-valerolactone	5379.12
n-decanol	1978.81
triethyl phosphate	1894.04
4-methyl-2-pentanol	2782.09
propionitrile	2735.47
vinylene carbonate	2822.3
1,1,2-trichlorotrifluoroethane	3704.91
DMS	2234.47
cumene	2131.51
2-octanol	2818.51
2-hexanone	4545.24
octyl acetate	2677.53
limonene	4229.43
1,2-dimethoxyethane	5908.27
ethyl orthosilicate	2221.07
tributyl phosphate	1835.28
diacetone alcohol	3118.88
N,N-dimethylaniline	2142.94
acrylonitrile	2226.58
aniline	2172.63
1,3-propanediol	1776.86
bromobenzene	4322.77
dibromomethane	7844.97
1,1,2,2-tetrachloroethane	8937.78
2-methyl-cyclohexyl acetate	3904.74
tetrabutyl urea	2019.13
diisobutyl methanol	3196.9
2-phenylethanol	2513.34
styrene	2754.97
dioctyl adipate	2619.99
dimethyl sulfate	1001.08
ethyl butyrate	5496.57
methyl lactate	954.24
butyl lactate	2967.75
diethyl carbonate	3057.88
propanediol butyl ether	2470.17
triethyl orthoformate	4016.23
p-tert-butyltoluene	2412.12
methyl 4-tert-butylbenzoate	2433.92
morpholine	5435.69
tert-butylamine	4587.74
n-dodecanol	1518.73
dimethoxymethane	2224.75
ethylene carbonate	3025.77
cyrene	1447.46
2-ethoxyethyl acetate	3976.8
2-ethylhexyl acetate	6772.19
1,2,4-trichlorobenzene	3514.24
4-methylpyridine	5166.23
dibutyl ether	6323.05
2,6-dimethyl-4-heptanol	3196.9
DEF	3875.38
dimethyl isosorbide	3192.58
tetrachloroethylene	6482.65
eugenol	2022.07
triacetin	3130.72
span 80	2521.56
1,4-butanediol	962.57
1,1-dichloroethane	7120.27
2-methyl-1-pentanol	3653.58
methyl formate	1049.0
2-methyl-1-butanol	3976.91
n-decane	1597.87
butyronitrile	4729.87
3,7-dimethyl-1-octanol	3608.87
1-chlorooctane	3451.63
1-chlorotetradecane	1390.23
n-nonane	1868.4
undecane	1066.73
tert-butylcyclohexane	2274.57
cyclooctane	2393.54
cyclopentanol	3662.04
tetrahydropyran	8009.13
tert-amyl methyl ether	4852.07
2,5,8-trioxanonane	3121.75
1-hexene	6172.13
2-isopropoxyethanol	2653.73
2,2,2-trifluoroethanol	812.14
methyl butyrate	5467.81

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