Molecular formula
C8H14O3

SMILES
CCCCC1C(=O)OCCO1

Fragrance
Fruity	77.37%
Caramellic	68.52%
Buttery	51.7%
Sweet	47.68%
Fatty	41.42%
Winey	36.79%
Lactonic	36.07%
Creamy	36.02%
Nutty	34.83%
Oily	31.57%

 

Flavor
Sweet	76.9%
Coconut	71.05%
Creamy	59.73%
Fatty	55.06%
Caramel	51.97%
Oily	48.48%
Peach	47.46%
Buttery	46.93%
Tonka	45.38%
Waxy	43.53%

 

Odor impact est.
Medium

XLogP3-AA
1.6

pKa est.
6.12 (neutral)

Molecular weight
158.19 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Slow

Boiling point est.
243°C

Flash point

• 85.29 ˚C est.

3-Butyl-1,4-dioxan-2-one primarily serves as a reactive intermediate and functional monomer in polymer chemistry, where it can participate in ring-opening polymerization to yield aliphatic polycarbonates with tunable properties. In practical formulations, it may function as a solvent or processing aid, a potential plasticizer for polymers, and a component in coatings, inks, and adhesives formulations. It is also evaluated for use in specialty cleaning formulations and as a processing additive in electronics-related applications, all subject to local regulations and formulation limits.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	716.72
methanol	1174.82
isopropanol	375.04
water	3.36
ethyl acetate	381.65
n-propanol	424.71
acetone	527.3
n-butanol	346.14
acetonitrile	507.48
DMF	615.87
toluene	120.2
isobutanol	281.42
1,4-dioxane	574.8
methyl acetate	334.62
THF	498.03
2-butanone	281.92
n-pentanol	227.35
sec-butanol	254.69
n-hexane	9.14
ethylene glycol	235.14
NMP	534.44
cyclohexane	44.84
DMSO	947.69
n-butyl acetate	298.7
n-octanol	114.04
chloroform	1503.16
n-propyl acetate	203.99
acetic acid	1367.36
dichloromethane	1585.03
cyclohexanone	569.17
propylene glycol	191.68
isopropyl acetate	196.11
DMAc	396.01
2-ethoxyethanol	370.87
isopentanol	256.98
n-heptane	10.82
ethyl formate	422.23
1,2-dichloroethane	751.56
n-hexanol	204.41
2-methoxyethanol	670.06
isobutyl acetate	120.21
tetrachloromethane	145.0
n-pentyl acetate	169.2
transcutol	1104.21
n-heptanol	95.56
ethylbenzene	73.39
MIBK	134.93
2-propoxyethanol	346.04
tert-butanol	422.55
MTBE	182.85
2-butoxyethanol	208.32
propionic acid	524.09
o-xylene	100.76
formic acid	549.45
diethyl ether	180.62
m-xylene	90.59
p-xylene	109.89
chlorobenzene	389.61
dimethyl carbonate	111.99
n-octane	6.72
formamide	645.01
cyclopentanone	490.28
2-pentanone	224.25
anisole	176.82
cyclopentyl methyl ether	186.17
gamma-butyrolactone	768.29
1-methoxy-2-propanol	365.5
pyridine	629.74
3-pentanone	140.39
furfural	838.12
n-dodecane	8.96
diethylene glycol	377.54
diisopropyl ether	46.15
tert-amyl alcohol	268.48
acetylacetone	336.17
n-hexadecane	10.32
acetophenone	214.21
methyl propionate	234.59
isopentyl acetate	234.06
trichloroethylene	1508.21
n-nonanol	95.85
cyclohexanol	322.93
benzyl alcohol	238.02
2-ethylhexanol	123.43
isooctanol	80.13
dipropyl ether	86.0
1,2-dichlorobenzene	350.64
ethyl lactate	123.94
propylene carbonate	472.43
n-methylformamide	511.17
2-pentanol	167.22
n-pentane	12.67
1-propoxy-2-propanol	229.62
1-methoxy-2-propyl acetate	213.58
2-(2-methoxypropoxy) propanol	216.4
mesitylene	66.53
ε-caprolactone	532.17
p-cymene	69.0
epichlorohydrin	748.68
1,1,1-trichloroethane	539.57
2-aminoethanol	346.74
morpholine-4-carbaldehyde	559.19
sulfolane	791.49
2,2,4-trimethylpentane	12.32
2-methyltetrahydrofuran	335.54
n-hexyl acetate	230.41
isooctane	9.57
2-(2-butoxyethoxy)ethanol	303.98
sec-butyl acetate	120.88
tert-butyl acetate	173.19
decalin	20.79
glycerin	294.74
diglyme	546.03
acrylic acid	532.89
isopropyl myristate	85.02
n-butyric acid	720.51
acetyl acetate	328.2
di(2-ethylhexyl) phthalate	106.01
ethyl propionate	160.7
nitromethane	1273.65
1,2-diethoxyethane	265.71
benzonitrile	408.52
trioctyl phosphate	74.09
1-bromopropane	262.18
gamma-valerolactone	706.43
n-decanol	69.76
triethyl phosphate	95.79
4-methyl-2-pentanol	95.29
propionitrile	352.42
vinylene carbonate	513.25
1,1,2-trichlorotrifluoroethane	649.56
DMS	184.18
cumene	58.43
2-octanol	69.59
2-hexanone	157.43
octyl acetate	111.52
limonene	98.14
1,2-dimethoxyethane	449.65
ethyl orthosilicate	86.26
tributyl phosphate	96.6
diacetone alcohol	216.03
N,N-dimethylaniline	113.17
acrylonitrile	561.18
aniline	277.92
1,3-propanediol	462.01
bromobenzene	398.44
dibromomethane	859.02
1,1,2,2-tetrachloroethane	1024.92
2-methyl-cyclohexyl acetate	145.21
tetrabutyl urea	124.28
diisobutyl methanol	76.83
2-phenylethanol	217.05
styrene	112.51
dioctyl adipate	144.18
dimethyl sulfate	193.33
ethyl butyrate	181.31
methyl lactate	166.19
butyl lactate	150.97
diethyl carbonate	149.22
propanediol butyl ether	227.69
triethyl orthoformate	126.35
p-tert-butyltoluene	61.43
methyl 4-tert-butylbenzoate	182.06
morpholine	641.05
tert-butylamine	217.44
n-dodecanol	54.12
dimethoxymethane	260.7
ethylene carbonate	408.25
cyrene	194.55
2-ethoxyethyl acetate	232.97
2-ethylhexyl acetate	166.85
1,2,4-trichlorobenzene	394.99
4-methylpyridine	482.91
dibutyl ether	109.27
2,6-dimethyl-4-heptanol	76.83
DEF	305.05
dimethyl isosorbide	310.97
tetrachloroethylene	748.85
eugenol	197.81
triacetin	235.04
span 80	207.37
1,4-butanediol	187.8
1,1-dichloroethane	617.48
2-methyl-1-pentanol	188.09
methyl formate	402.98
2-methyl-1-butanol	236.88
n-decane	13.14
butyronitrile	384.93
3,7-dimethyl-1-octanol	113.89
1-chlorooctane	69.87
1-chlorotetradecane	30.9
n-nonane	11.62
undecane	10.39
tert-butylcyclohexane	16.73
cyclooctane	11.68
cyclopentanol	337.01
tetrahydropyran	414.08
tert-amyl methyl ether	116.24
2,5,8-trioxanonane	393.25
1-hexene	52.56
2-isopropoxyethanol	212.99
2,2,2-trifluoroethanol	322.2
methyl butyrate	250.58

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