Molecular formula
C9H16O3

SMILES
C1CCCCOC(=O)OCCC1

Fragrance
Sweet	70.21%
Fruity	57.48%
Musk	48.56%
Woody	43.9%
Coumarinic	41.71%
Floral	41.45%
Animal	41.04%
Oily	40.75%
Coconut	39.48%
Tobacco	37.17%

 

Flavor
Fruity	58.07%
Sweet	40.35%
Coconut	32.81%
Creamy	30.45%
Fruit	29.12%
Fatty	28.3%
Animal	27.6%
Coumarin	26.73%
Caramel	26.42%
Tonka	26.19%

 

Odor impact est.
Medium

XLogP3-AA
2.8

pKa est.
7.3 (neutral)

Molecular weight
172.22 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
375°C

Flash point

• 107.38 ˚C est.

• SCHEMBL1840259

1,3-Dioxacycloundecan-2-one is a cyclic carbonate that is used primarily as a reactive intermediate and processing aid in polymer chemistry. It can function as a monomer or co-monomer in ring-opening polymerization to prepare polycarbonate-type materials, and it can act as a crosslinking agent or functional building block for polyurethanes and polyesters. In formulation work it is evaluated as a solvent or processing diluent, and as a high-boiling additive to adjust viscosity, flow, and drying in coatings, inks, and adhesive systems. It may also be used as a starting material for functionalized cyclic carbonates that introduce carbonate groups into materials for specialty applications, including electronics-related coatings or optically clear polymers, subject to formulation limits and local regulations.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	333.26
methanol	422.51
isopropanol	349.61
water	0.25
ethyl acetate	362.64
n-propanol	308.15
acetone	805.91
n-butanol	256.12
acetonitrile	465.32
DMF	1321.06
toluene	232.0
isobutanol	260.95
1,4-dioxane	528.45
methyl acetate	403.82
THF	986.15
2-butanone	569.3
n-pentanol	205.29
sec-butanol	282.07
n-hexane	41.64
ethylene glycol	79.44
NMP	1149.21
cyclohexane	64.99
DMSO	1422.09
n-butyl acetate	326.91
n-octanol	153.38
chloroform	1931.87
n-propyl acetate	319.86
acetic acid	508.75
dichloromethane	1842.29
cyclohexanone	908.07
propylene glycol	130.13
isopropyl acetate	269.8
DMAc	844.95
2-ethoxyethanol	275.93
isopentanol	236.33
n-heptane	23.21
ethyl formate	334.65
1,2-dichloroethane	1143.65
n-hexanol	185.45
2-methoxyethanol	476.39
isobutyl acetate	195.27
tetrachloromethane	188.7
n-pentyl acetate	305.19
transcutol	725.73
n-heptanol	118.01
ethylbenzene	140.6
MIBK	268.56
2-propoxyethanol	307.59
tert-butanol	369.34
MTBE	285.49
2-butoxyethanol	240.63
propionic acid	440.22
o-xylene	169.85
formic acid	130.58
diethyl ether	266.18
m-xylene	168.3
p-xylene	201.66
chlorobenzene	507.88
dimethyl carbonate	175.04
n-octane	18.25
formamide	255.91
cyclopentanone	1284.96
2-pentanone	446.69
anisole	255.98
cyclopentyl methyl ether	404.75
gamma-butyrolactone	1409.84
1-methoxy-2-propanol	393.63
pyridine	858.12
3-pentanone	341.4
furfural	994.81
n-dodecane	17.46
diethylene glycol	211.9
diisopropyl ether	93.5
tert-amyl alcohol	288.79
acetylacetone	527.27
n-hexadecane	20.35
acetophenone	323.08
methyl propionate	354.67
isopentyl acetate	270.09
trichloroethylene	2015.46
n-nonanol	130.6
cyclohexanol	304.25
benzyl alcohol	234.97
2-ethylhexanol	121.75
isooctanol	105.16
dipropyl ether	144.41
1,2-dichlorobenzene	487.67
ethyl lactate	159.26
propylene carbonate	741.71
n-methylformamide	591.52
2-pentanol	202.43
n-pentane	33.14
1-propoxy-2-propanol	241.13
1-methoxy-2-propyl acetate	252.37
2-(2-methoxypropoxy) propanol	212.64
mesitylene	113.31
ε-caprolactone	693.54
p-cymene	89.45
epichlorohydrin	1132.67
1,1,1-trichloroethane	840.97
2-aminoethanol	174.8
morpholine-4-carbaldehyde	743.22
sulfolane	1885.34
2,2,4-trimethylpentane	22.97
2-methyltetrahydrofuran	642.84
n-hexyl acetate	384.13
isooctane	17.32
2-(2-butoxyethoxy)ethanol	313.67
sec-butyl acetate	202.54
tert-butyl acetate	293.26
decalin	42.17
glycerin	194.06
diglyme	546.4
acrylic acid	428.15
isopropyl myristate	128.89
n-butyric acid	557.01
acetyl acetate	277.42
di(2-ethylhexyl) phthalate	129.52
ethyl propionate	260.93
nitromethane	881.35
1,2-diethoxyethane	252.43
benzonitrile	428.57
trioctyl phosphate	100.5
1-bromopropane	554.53
gamma-valerolactone	1065.78
n-decanol	93.77
triethyl phosphate	116.73
4-methyl-2-pentanol	118.04
propionitrile	423.4
vinylene carbonate	614.19
1,1,2-trichlorotrifluoroethane	757.35
DMS	281.57
cumene	100.45
2-octanol	107.47
2-hexanone	323.33
octyl acetate	172.82
limonene	124.88
1,2-dimethoxyethane	497.65
ethyl orthosilicate	104.72
tributyl phosphate	123.92
diacetone alcohol	319.34
N,N-dimethylaniline	188.85
acrylonitrile	628.16
aniline	293.62
1,3-propanediol	251.45
bromobenzene	598.53
dibromomethane	1216.62
1,1,2,2-tetrachloroethane	1667.48
2-methyl-cyclohexyl acetate	186.85
tetrabutyl urea	174.77
diisobutyl methanol	84.41
2-phenylethanol	194.54
styrene	198.9
dioctyl adipate	192.11
dimethyl sulfate	381.55
ethyl butyrate	220.32
methyl lactate	217.45
butyl lactate	231.57
diethyl carbonate	159.71
propanediol butyl ether	266.0
triethyl orthoformate	146.31
p-tert-butyltoluene	85.79
methyl 4-tert-butylbenzoate	273.04
morpholine	655.12
tert-butylamine	221.08
n-dodecanol	72.25
dimethoxymethane	423.78
ethylene carbonate	490.79
cyrene	252.81
2-ethoxyethyl acetate	308.55
2-ethylhexyl acetate	213.46
1,2,4-trichlorobenzene	551.45
4-methylpyridine	656.23
dibutyl ether	174.81
2,6-dimethyl-4-heptanol	84.41
DEF	544.89
dimethyl isosorbide	374.6
tetrachloroethylene	988.46
eugenol	254.42
triacetin	307.0
span 80	225.54
1,4-butanediol	112.22
1,1-dichloroethane	1065.94
2-methyl-1-pentanol	179.71
methyl formate	400.27
2-methyl-1-butanol	218.95
n-decane	28.13
butyronitrile	417.96
3,7-dimethyl-1-octanol	132.38
1-chlorooctane	135.11
1-chlorotetradecane	51.99
n-nonane	27.64
undecane	21.24
tert-butylcyclohexane	34.54
cyclooctane	22.08
cyclopentanol	453.89
tetrahydropyran	558.37
tert-amyl methyl ether	210.81
2,5,8-trioxanonane	357.51
1-hexene	165.53
2-isopropoxyethanol	204.09
2,2,2-trifluoroethanol	187.83
methyl butyrate	406.97

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