Molecular formula
C15H28O4

SMILES
CCCCCCCCCCC(C(=O)OC)OC(=O)C

Fragrance
Fatty	57.96%
Buttery	46.14%
Waxy	44.25%
Oily	42.97%
Lactonic	42.7%
Fruity	41.35%
Peach	40.55%
Milky	37.43%
Creamy	37.21%
Dairy	32.78%

 

Flavor
Waxy	59.33%
Fruity	56.34%
Oily	49.88%
Soapy	37.47%
Creamy	36.64%
Fatty	33.86%
Sweet	33.81%
Green	33.5%
Mild	32.97%
Tropical	29.31%

 

Odor impact est.
Medium

XLogP3-AA
5.1

pKa est.
6.68 (neutral)

Molecular weight
272.38 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
310°C

Flash point

• 135.86 ˚C est.

Methyl 2-acetyloxydodecanoate is primarily used as a fragrance ingredient in perfumery and personal care products, contributing fruity or floral notes; it is also evaluated for potential use as a flavor/aroma compound in selected applications. In cosmetics and personal care, it can serve as a scent component in creams, lotions, and hair-care formulations. It is sometimes employed as an intermediate in organic synthesis to access related ester fragrances and aroma compounds. In household products and cleaning formulations, it can be used to impart pleasant odors. In polymers, coatings or inks, it may be used as a precursor or additive for fragrance-release systems or fragrance-containing formulations, subject to formulation constraints and local regulations.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	1003.74
methanol	1421.88
isopropanol	908.42
water	0.13
ethyl acetate	1934.76
n-propanol	879.17
acetone	2346.3
n-butanol	737.34
acetonitrile	1321.36
DMF	2184.47
toluene	731.63
isobutanol	713.21
1,4-dioxane	1633.03
methyl acetate	1370.15
THF	2468.33
2-butanone	1715.56
n-pentanol	583.77
sec-butanol	877.79
n-hexane	73.48
ethylene glycol	69.68
NMP	2251.64
cyclohexane	289.54
DMSO	2741.42
n-butyl acetate	1142.88
n-octanol	198.9
chloroform	2748.64
n-propyl acetate	1344.37
acetic acid	1032.6
dichloromethane	3347.89
cyclohexanone	3131.11
propylene glycol	154.23
isopropyl acetate	1286.52
DMAc	2127.53
2-ethoxyethanol	980.26
isopentanol	770.1
n-heptane	31.05
ethyl formate	930.99
1,2-dichloroethane	2577.03
n-hexanol	394.13
2-methoxyethanol	1308.34
isobutyl acetate	725.03
tetrachloromethane	464.21
n-pentyl acetate	814.4
transcutol	2109.83
n-heptanol	208.46
ethylbenzene	366.26
MIBK	930.67
2-propoxyethanol	757.06
tert-butanol	1234.92
MTBE	1369.35
2-butoxyethanol	537.47
propionic acid	771.95
o-xylene	483.11
formic acid	232.16
diethyl ether	1230.52
m-xylene	462.16
p-xylene	547.95
chlorobenzene	1020.59
dimethyl carbonate	346.8
n-octane	19.17
formamide	517.07
cyclopentanone	2700.71
2-pentanone	1581.57
anisole	676.66
cyclopentyl methyl ether	1428.64
gamma-butyrolactone	2624.38
1-methoxy-2-propanol	973.92
pyridine	2006.77
3-pentanone	1108.81
furfural	1897.09
n-dodecane	14.3
diethylene glycol	415.9
diisopropyl ether	328.36
tert-amyl alcohol	1116.64
acetylacetone	1704.75
n-hexadecane	17.73
acetophenone	811.42
methyl propionate	1196.8
isopentyl acetate	1038.36
trichloroethylene	3815.05
n-nonanol	181.82
cyclohexanol	1127.85
benzyl alcohol	568.2
2-ethylhexanol	284.44
isooctanol	205.26
dipropyl ether	387.49
1,2-dichlorobenzene	924.8
ethyl lactate	359.43
propylene carbonate	1321.77
n-methylformamide	1050.11
2-pentanol	575.22
n-pentane	59.75
1-propoxy-2-propanol	581.52
1-methoxy-2-propyl acetate	842.48
2-(2-methoxypropoxy) propanol	433.79
mesitylene	281.78
ε-caprolactone	2455.78
p-cymene	187.67
epichlorohydrin	2835.04
1,1,1-trichloroethane	2231.4
2-aminoethanol	262.96
morpholine-4-carbaldehyde	1662.34
sulfolane	2699.34
2,2,4-trimethylpentane	51.92
2-methyltetrahydrofuran	2218.32
n-hexyl acetate	789.02
isooctane	30.82
2-(2-butoxyethoxy)ethanol	618.26
sec-butyl acetate	892.2
tert-butyl acetate	1202.51
decalin	109.83
glycerin	206.64
diglyme	1406.58
acrylic acid	511.43
isopropyl myristate	224.03
n-butyric acid	1532.01
acetyl acetate	1070.5
di(2-ethylhexyl) phthalate	219.27
ethyl propionate	1113.44
nitromethane	2273.24
1,2-diethoxyethane	916.97
benzonitrile	875.19
trioctyl phosphate	152.36
1-bromopropane	1315.68
gamma-valerolactone	3070.2
n-decanol	117.7
triethyl phosphate	286.83
4-methyl-2-pentanol	312.42
propionitrile	1078.72
vinylene carbonate	1059.76
1,1,2-trichlorotrifluoroethane	1517.51
DMS	578.63
cumene	225.81
2-octanol	184.93
2-hexanone	1055.18
octyl acetate	280.04
limonene	331.63
1,2-dimethoxyethane	1883.42
ethyl orthosilicate	269.52
tributyl phosphate	214.67
diacetone alcohol	980.85
N,N-dimethylaniline	436.71
acrylonitrile	1218.12
aniline	724.51
1,3-propanediol	509.41
bromobenzene	1158.91
dibromomethane	2155.26
1,1,2,2-tetrachloroethane	3267.58
2-methyl-cyclohexyl acetate	538.21
tetrabutyl urea	291.74
diisobutyl methanol	172.9
2-phenylethanol	428.32
styrene	495.67
dioctyl adipate	371.72
dimethyl sulfate	609.68
ethyl butyrate	730.91
methyl lactate	375.57
butyl lactate	505.91
diethyl carbonate	430.53
propanediol butyl ether	416.93
triethyl orthoformate	427.22
p-tert-butyltoluene	174.56
methyl 4-tert-butylbenzoate	528.46
morpholine	2367.95
tert-butylamine	686.3
n-dodecanol	84.88
dimethoxymethane	1134.51
ethylene carbonate	1056.09
cyrene	500.99
2-ethoxyethyl acetate	909.31
2-ethylhexyl acetate	769.01
1,2,4-trichlorobenzene	1052.98
4-methylpyridine	1917.86
dibutyl ether	407.99
2,6-dimethyl-4-heptanol	172.9
DEF	1808.01
dimethyl isosorbide	824.48
tetrachloroethylene	2073.19
eugenol	463.67
triacetin	680.8
span 80	391.52
1,4-butanediol	232.26
1,1-dichloroethane	2285.86
2-methyl-1-pentanol	596.14
methyl formate	675.63
2-methyl-1-butanol	720.23
n-decane	28.61
butyronitrile	1183.34
3,7-dimethyl-1-octanol	231.31
1-chlorooctane	202.83
1-chlorotetradecane	61.08
n-nonane	27.79
undecane	18.63
tert-butylcyclohexane	74.0
cyclooctane	54.19
cyclopentanol	1077.49
tetrahydropyran	2303.81
tert-amyl methyl ether	952.72
2,5,8-trioxanonane	794.6
1-hexene	380.6
2-isopropoxyethanol	691.59
2,2,2-trifluoroethanol	342.45
methyl butyrate	1697.67

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