Molecular formula
C9H18O

SMILES
CCCCCC(=C(C)O)C

Fragrance
Fruity	64.66%
Floral	64.58%
Herbal	63.68%
Green	53.98%
Fresh	49.3%
Citrus	45.2%
Spicy	44.3%
Earthy	42.51%
Oily	40.36%
Fatty	39.05%

 

Flavor
Floral	61.31%
Woody	50.19%
Citrus	46.54%
Sweet	41.68%
Green	40.84%
Herbal	39.64%
Fruity	39.18%
Earthy	38.95%
Spicy	37.1%
Fresh	35.01%

 

Odor impact est.
High

XLogP3-AA
3.8

pKa est.
11.15 (strong base)

Molecular weight
142.24 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Moderate

Boiling point est.
201°C

Flash point

• 79.26 ˚C est.

• dimethylheptenol
• SCHEMBL2811858

Dimethylheptenol is primarily used as an odorant and fragrance ingredient in perfumery and cosmetics, contributing to distinctive aroma notes; it can also serve as an intermediate in fragrance synthesis within industrial manufacturing; in household products such as air fresheners and cleaners, it is used to impart and stabilize scent; in coatings and inks, as well as adhesives, it may be added as a fragrance additive or formulation aid; these applications are formulation-specific and subject to local regulations and limits.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	11235.12
methanol	8907.52
isopropanol	10483.3
water	1.16
ethyl acetate	5001.55
n-propanol	9421.46
acetone	6335.3
n-butanol	9053.31
acetonitrile	5391.68
DMF	2899.26
toluene	1452.08
isobutanol	6454.79
1,4-dioxane	7292.57
methyl acetate	3457.18
THF	8618.67
2-butanone	5223.32
n-pentanol	5218.18
sec-butanol	8812.21
n-hexane	2684.72
ethylene glycol	613.79
NMP	1657.03
cyclohexane	1791.43
DMSO	3077.93
n-butyl acetate	5395.05
n-octanol	1873.84
chloroform	6836.96
n-propyl acetate	3155.92
acetic acid	2831.63
dichloromethane	5178.08
cyclohexanone	5110.47
propylene glycol	1377.8
isopropyl acetate	2813.76
DMAc	1615.35
2-ethoxyethanol	3497.37
isopentanol	6814.0
n-heptane	1100.91
ethyl formate	2554.52
1,2-dichloroethane	3407.98
n-hexanol	6621.83
2-methoxyethanol	5458.05
isobutyl acetate	1589.21
tetrachloromethane	1766.25
n-pentyl acetate	2107.86
transcutol	7487.6
n-heptanol	2203.46
ethylbenzene	856.38
MIBK	2135.05
2-propoxyethanol	5329.65
tert-butanol	11102.26
MTBE	8748.49
2-butoxyethanol	2748.66
propionic acid	2910.84
o-xylene	749.48
formic acid	625.91
diethyl ether	8203.99
m-xylene	868.94
p-xylene	1042.84
chlorobenzene	1613.29
dimethyl carbonate	382.6
n-octane	303.75
formamide	912.63
cyclopentanone	4110.88
2-pentanone	4594.02
anisole	1491.96
cyclopentyl methyl ether	3880.05
gamma-butyrolactone	3397.1
1-methoxy-2-propanol	4058.38
pyridine	4689.08
3-pentanone	2387.94
furfural	2321.09
n-dodecane	137.56
diethylene glycol	1924.96
diisopropyl ether	1923.93
tert-amyl alcohol	7572.71
acetylacetone	2172.76
n-hexadecane	155.94
acetophenone	923.44
methyl propionate	2221.67
isopentyl acetate	3857.73
trichloroethylene	4806.18
n-nonanol	1465.94
cyclohexanol	4799.62
benzyl alcohol	1229.65
2-ethylhexanol	3422.2
isooctanol	1634.13
dipropyl ether	4492.94
1,2-dichlorobenzene	1099.57
ethyl lactate	695.26
propylene carbonate	1790.07
n-methylformamide	2183.78
2-pentanol	5848.84
n-pentane	1675.87
1-propoxy-2-propanol	4267.79
1-methoxy-2-propyl acetate	2232.21
2-(2-methoxypropoxy) propanol	1267.63
mesitylene	519.28
ε-caprolactone	3899.9
p-cymene	594.91
epichlorohydrin	4313.1
1,1,1-trichloroethane	3963.24
2-aminoethanol	2406.69
morpholine-4-carbaldehyde	2541.13
sulfolane	2246.96
2,2,4-trimethylpentane	494.94
2-methyltetrahydrofuran	8202.47
n-hexyl acetate	2598.99
isooctane	433.53
2-(2-butoxyethoxy)ethanol	2275.41
sec-butyl acetate	1905.21
tert-butyl acetate	2434.17
decalin	500.76
glycerin	1078.19
diglyme	3676.12
acrylic acid	1491.97
isopropyl myristate	668.51
n-butyric acid	5987.55
acetyl acetate	1393.66
di(2-ethylhexyl) phthalate	486.68
ethyl propionate	2012.79
nitromethane	3129.62
1,2-diethoxyethane	4473.78
benzonitrile	1896.31
trioctyl phosphate	433.71
1-bromopropane	4319.78
gamma-valerolactone	4575.94
n-decanol	942.94
triethyl phosphate	528.4
4-methyl-2-pentanol	2426.28
propionitrile	5382.57
vinylene carbonate	1454.49
1,1,2-trichlorotrifluoroethane	2156.89
DMS	762.53
cumene	531.2
2-octanol	1523.29
2-hexanone	3763.73
octyl acetate	856.93
limonene	1235.47
1,2-dimethoxyethane	5923.26
ethyl orthosilicate	671.99
tributyl phosphate	560.57
diacetone alcohol	2325.98
N,N-dimethylaniline	787.5
acrylonitrile	3661.38
aniline	2243.75
1,3-propanediol	3601.42
bromobenzene	1601.8
dibromomethane	4388.55
1,1,2,2-tetrachloroethane	4021.25
2-methyl-cyclohexyl acetate	1253.51
tetrabutyl urea	612.36
diisobutyl methanol	1438.96
2-phenylethanol	1609.26
styrene	1120.69
dioctyl adipate	739.9
dimethyl sulfate	414.17
ethyl butyrate	2755.48
methyl lactate	682.34
butyl lactate	1205.85
diethyl carbonate	1182.86
propanediol butyl ether	1838.4
triethyl orthoformate	1517.51
p-tert-butyltoluene	593.71
methyl 4-tert-butylbenzoate	791.57
morpholine	10098.67
tert-butylamine	8788.8
n-dodecanol	650.81
dimethoxymethane	2324.34
ethylene carbonate	1569.02
cyrene	727.59
2-ethoxyethyl acetate	1879.97
2-ethylhexyl acetate	2707.8
1,2,4-trichlorobenzene	1159.01
4-methylpyridine	4339.39
dibutyl ether	2975.2
2,6-dimethyl-4-heptanol	1438.96
DEF	3531.68
dimethyl isosorbide	1454.39
tetrachloroethylene	2990.04
eugenol	809.36
triacetin	1028.17
span 80	1471.84
1,4-butanediol	1163.33
1,1-dichloroethane	5303.73
2-methyl-1-pentanol	3782.32
methyl formate	1121.91
2-methyl-1-butanol	5911.93
n-decane	323.34
butyronitrile	7012.14
3,7-dimethyl-1-octanol	1773.46
1-chlorooctane	1085.5
1-chlorotetradecane	293.98
n-nonane	372.22
undecane	200.0
tert-butylcyclohexane	552.62
cyclooctane	452.11
cyclopentanol	4292.82
tetrahydropyran	10599.33
tert-amyl methyl ether	4079.03
2,5,8-trioxanonane	1815.19
1-hexene	6009.65
2-isopropoxyethanol	2482.76
2,2,2-trifluoroethanol	497.66
methyl butyrate	3162.93

Scent© AI