Molecular formula
C15H28O3

SMILES
C[C@@H]1C(=O)OCCCCCCCCCCCCO1

Fragrance
Musk	82.71%
Sweet	80.5%
Animal	61.45%
Amber	54.11%
Powdery	53.32%
Woody	53.23%
Floral	49.13%
Fruity	38.68%
Waxy	37.54%
Tobacco	35.29%

 

Flavor
Fruity	61.12%
Animal	28.41%
Fruit	26.73%
Caramel	25.91%
Minty	25.79%
Natural	24.5%
Sweet	23.79%
Coconut	23.57%
Musk	21.9%
Powdery	21.53%

 

Odor impact est.
High

XLogP3-AA
4.9

pKa est.
11.53 (strong base)

Molecular weight
256.38 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
326°C

Flash point

• 146.32 ˚C est.

• SCHEMBL7106044

(3R)-3-methyl-1,4-dioxacyclohexadecan-2-one is primarily used as an intermediate for the synthesis of cyclic diesters and specialty polyesters, serving as a building block for certain polymer materials; it may be employed as a precursor or monomer for polymer systems and can also function as a reactive solvent or processing aid in industrial manufacturing and formulation steps; the compound is commonly evaluated as a precursor in pharmaceutical and agrochemical syntheses; additional potential applications include coatings formulations, adhesives, and cleaning product formulations, subject to local regulations and formulation limits.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	1276.92
methanol	1284.36
isopropanol	1337.13
water	0.15
ethyl acetate	3809.99
n-propanol	1253.8
acetone	4074.29
n-butanol	1242.04
acetonitrile	2953.52
DMF	2966.88
toluene	1996.43
isobutanol	1085.5
1,4-dioxane	3020.12
methyl acetate	2264.43
THF	4146.08
2-butanone	2750.75
n-pentanol	786.05
sec-butanol	1202.53
n-hexane	444.3
ethylene glycol	120.38
NMP	2874.64
cyclohexane	1422.97
DMSO	3468.06
n-butyl acetate	2579.02
n-octanol	535.53
chloroform	8369.67
n-propyl acetate	2403.91
acetic acid	2069.61
dichloromethane	8384.89
cyclohexanone	5540.67
propylene glycol	226.13
isopropyl acetate	2473.28
DMAc	2124.95
2-ethoxyethanol	1129.65
isopentanol	1295.17
n-heptane	302.26
ethyl formate	1834.42
1,2-dichloroethane	5663.32
n-hexanol	831.58
2-methoxyethanol	1729.59
isobutyl acetate	1277.25
tetrachloromethane	1643.19
n-pentyl acetate	2088.52
transcutol	4387.28
n-heptanol	513.96
ethylbenzene	922.78
MIBK	1699.92
2-propoxyethanol	1246.85
tert-butanol	1681.96
MTBE	2124.38
2-butoxyethanol	1046.96
propionic acid	1543.99
o-xylene	1164.05
formic acid	408.62
diethyl ether	2561.62
m-xylene	1168.53
p-xylene	1213.2
chlorobenzene	2880.59
dimethyl carbonate	795.85
n-octane	130.53
formamide	866.2
cyclopentanone	4675.97
2-pentanone	2979.8
anisole	1346.83
cyclopentyl methyl ether	2618.12
gamma-butyrolactone	4870.8
1-methoxy-2-propanol	1422.82
pyridine	4606.05
3-pentanone	2164.66
furfural	3798.89
n-dodecane	75.12
diethylene glycol	672.97
diisopropyl ether	927.8
tert-amyl alcohol	1411.21
acetylacetone	3072.91
n-hexadecane	92.92
acetophenone	1429.83
methyl propionate	2117.04
isopentyl acetate	1938.93
trichloroethylene	9131.84
n-nonanol	461.91
cyclohexanol	2238.66
benzyl alcohol	978.94
2-ethylhexanol	717.08
isooctanol	493.76
dipropyl ether	1294.96
1,2-dichlorobenzene	2579.75
ethyl lactate	622.01
propylene carbonate	2727.87
n-methylformamide	1559.63
2-pentanol	1157.86
n-pentane	408.7
1-propoxy-2-propanol	1205.0
1-methoxy-2-propyl acetate	1611.92
2-(2-methoxypropoxy) propanol	768.68
mesitylene	775.47
ε-caprolactone	4152.93
p-cymene	565.99
epichlorohydrin	4942.39
1,1,1-trichloroethane	5262.82
2-aminoethanol	375.35
morpholine-4-carbaldehyde	2483.31
sulfolane	4954.29
2,2,4-trimethylpentane	195.61
2-methyltetrahydrofuran	3409.23
n-hexyl acetate	1969.53
isooctane	145.8
2-(2-butoxyethoxy)ethanol	1204.09
sec-butyl acetate	1543.87
tert-butyl acetate	2150.34
decalin	383.13
glycerin	336.77
diglyme	2602.51
acrylic acid	1228.14
isopropyl myristate	592.94
n-butyric acid	3145.12
acetyl acetate	2344.04
di(2-ethylhexyl) phthalate	449.55
ethyl propionate	1959.79
nitromethane	4061.47
1,2-diethoxyethane	2182.25
benzonitrile	2047.46
trioctyl phosphate	355.91
1-bromopropane	3203.89
gamma-valerolactone	4796.06
n-decanol	304.25
triethyl phosphate	619.09
4-methyl-2-pentanol	676.25
propionitrile	2296.22
vinylene carbonate	2459.75
1,1,2-trichlorotrifluoroethane	2891.44
DMS	1325.45
cumene	543.09
2-octanol	466.47
2-hexanone	1760.89
octyl acetate	720.63
limonene	947.21
1,2-dimethoxyethane	2400.02
ethyl orthosilicate	583.54
tributyl phosphate	505.89
diacetone alcohol	1466.23
N,N-dimethylaniline	780.88
acrylonitrile	2622.04
aniline	1859.22
1,3-propanediol	799.92
bromobenzene	3603.27
dibromomethane	5805.85
1,1,2,2-tetrachloroethane	7248.17
2-methyl-cyclohexyl acetate	1026.12
tetrabutyl urea	599.21
diisobutyl methanol	506.02
2-phenylethanol	819.79
styrene	1314.92
dioctyl adipate	868.04
dimethyl sulfate	1259.96
ethyl butyrate	1696.92
methyl lactate	726.36
butyl lactate	1061.13
diethyl carbonate	1039.12
propanediol butyl ether	825.31
triethyl orthoformate	1026.71
p-tert-butyltoluene	507.79
methyl 4-tert-butylbenzoate	1068.05
morpholine	3520.6
tert-butylamine	1179.23
n-dodecanol	229.3
dimethoxymethane	1747.99
ethylene carbonate	2359.88
cyrene	700.74
2-ethoxyethyl acetate	2014.39
2-ethylhexyl acetate	1596.71
1,2,4-trichlorobenzene	2689.52
4-methylpyridine	3815.37
dibutyl ether	1393.0
2,6-dimethyl-4-heptanol	506.02
DEF	3016.71
dimethyl isosorbide	1425.29
tetrachloroethylene	5132.42
eugenol	823.87
triacetin	1517.62
span 80	826.42
1,4-butanediol	307.4
1,1-dichloroethane	5342.56
2-methyl-1-pentanol	777.57
methyl formate	1224.04
2-methyl-1-butanol	1145.14
n-decane	154.23
butyronitrile	2506.8
3,7-dimethyl-1-octanol	596.77
1-chlorooctane	687.86
1-chlorotetradecane	221.27
n-nonane	166.23
undecane	100.96
tert-butylcyclohexane	269.94
cyclooctane	383.18
cyclopentanol	1876.03
tetrahydropyran	4254.85
tert-amyl methyl ether	1505.04
2,5,8-trioxanonane	1393.83
1-hexene	1118.46
2-isopropoxyethanol	878.44
2,2,2-trifluoroethanol	769.73
methyl butyrate	2760.89

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