Molecular formula
C6H8O3

SMILES
C[C@@H]1C(=O)C(=O)C(O1)C

Fragrance
Caramellic	87.44%
Burnt	64.47%
Sweet	64.28%
Roasted	46.54%
Coffee	44.84%
Buttery	44.54%
Nutty	40.66%
Rummy	23.82%
Creamy	23.62%
Milky	22.14%

 

Flavor
Sweet	80.6%
Caramel	76.3%
Maple	51.01%
Sugar	44.34%
Candy	43.4%
Bread	41.35%
Buttery	35.11%
Almond	33.31%
Cotton	32.7%
Creamy	31.84%

 

Odor impact est.
High

XLogP3-AA
0.1

pKa est.
6.19 (neutral)

Molecular weight
128.13 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Fast

Boiling point est.
183°C

Flash point

• 76.46 ˚C est.

Applications of (2R)-2,5-dimethyloxolane-3,4-dione are mainly as an intermediate in industrial and research chemical synthesis; in pharmaceuticals, it serves as a building block for organic synthesis and chiral intermediates; in the agricultural sector, it is evaluated as an intermediate for the synthesis of biologically active compounds; in the field of polymers and plastics, it is studied as a building block for chiral monomers or functional polymers; in research and development, it is often used as a scaffold for asymmetric synthesis and as a platform for developing new synthetic routes.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	118.5
methanol	233.29
isopropanol	71.24
water	46.24
ethyl acetate	137.56
n-propanol	90.13
acetone	245.9
n-butanol	72.31
acetonitrile	275.55
DMF	294.18
toluene	47.76
isobutanol	55.57
1,4-dioxane	278.99
methyl acetate	171.6
THF	275.64
2-butanone	139.85
n-pentanol	61.43
sec-butanol	62.98
n-hexane	15.98
ethylene glycol	80.51
NMP	347.97
cyclohexane	20.17
DMSO	415.55
n-butyl acetate	69.41
n-octanol	33.1
chloroform	452.1
n-propyl acetate	82.0
acetic acid	290.26
dichloromethane	599.27
cyclohexanone	195.06
propylene glycol	37.03
isopropyl acetate	76.29
DMAc	232.62
2-ethoxyethanol	210.42
isopentanol	56.34
n-heptane	9.8
ethyl formate	144.93
1,2-dichloroethane	314.58
n-hexanol	42.91
2-methoxyethanol	294.48
isobutyl acetate	39.25
tetrachloromethane	96.55
n-pentyl acetate	57.58
transcutol	319.27
n-heptanol	26.8
ethylbenzene	41.59
MIBK	64.0
2-propoxyethanol	115.15
tert-butanol	81.48
MTBE	75.72
2-butoxyethanol	67.8
propionic acid	133.96
o-xylene	53.42
formic acid	321.1
diethyl ether	127.67
m-xylene	39.24
p-xylene	61.42
chlorobenzene	118.81
dimethyl carbonate	71.4
n-octane	5.78
formamide	490.79
cyclopentanone	246.8
2-pentanone	108.38
anisole	104.21
cyclopentyl methyl ether	115.14
gamma-butyrolactone	404.5
1-methoxy-2-propanol	139.45
pyridine	214.12
3-pentanone	101.46
furfural	409.61
n-dodecane	4.72
diethylene glycol	142.63
diisopropyl ether	37.14
tert-amyl alcohol	72.53
acetylacetone	162.15
n-hexadecane	5.44
acetophenone	116.79
methyl propionate	122.46
isopentyl acetate	57.8
trichloroethylene	532.96
n-nonanol	31.21
cyclohexanol	70.35
benzyl alcohol	90.07
2-ethylhexanol	32.55
isooctanol	23.69
dipropyl ether	45.34
1,2-dichlorobenzene	148.31
ethyl lactate	48.87
propylene carbonate	171.25
n-methylformamide	282.77
2-pentanol	49.32
n-pentane	13.89
1-propoxy-2-propanol	64.77
1-methoxy-2-propyl acetate	85.56
2-(2-methoxypropoxy) propanol	79.71
mesitylene	30.19
ε-caprolactone	186.32
p-cymene	29.8
epichlorohydrin	359.57
1,1,1-trichloroethane	212.65
2-aminoethanol	98.31
morpholine-4-carbaldehyde	317.41
sulfolane	416.26
2,2,4-trimethylpentane	9.84
2-methyltetrahydrofuran	184.95
n-hexyl acetate	77.59
isooctane	5.67
2-(2-butoxyethoxy)ethanol	98.22
sec-butyl acetate	50.32
tert-butyl acetate	81.81
decalin	14.21
glycerin	90.07
diglyme	224.32
acrylic acid	154.63
isopropyl myristate	32.67
n-butyric acid	119.5
acetyl acetate	118.85
di(2-ethylhexyl) phthalate	35.12
ethyl propionate	80.44
nitromethane	595.92
1,2-diethoxyethane	105.9
benzonitrile	132.42
trioctyl phosphate	23.47
1-bromopropane	114.24
gamma-valerolactone	335.09
n-decanol	22.5
triethyl phosphate	47.72
4-methyl-2-pentanol	29.24
propionitrile	127.84
vinylene carbonate	181.7
1,1,2-trichlorotrifluoroethane	233.9
DMS	107.03
cumene	33.19
2-octanol	22.57
2-hexanone	77.21
octyl acetate	39.93
limonene	37.19
1,2-dimethoxyethane	270.14
ethyl orthosilicate	43.59
tributyl phosphate	33.01
diacetone alcohol	85.78
N,N-dimethylaniline	75.84
acrylonitrile	208.53
aniline	79.78
1,3-propanediol	130.98
bromobenzene	115.85
dibromomethane	333.87
1,1,2,2-tetrachloroethane	324.92
2-methyl-cyclohexyl acetate	57.03
tetrabutyl urea	46.39
diisobutyl methanol	23.8
2-phenylethanol	62.49
styrene	53.85
dioctyl adipate	51.92
dimethyl sulfate	150.63
ethyl butyrate	64.2
methyl lactate	67.19
butyl lactate	43.47
diethyl carbonate	55.11
propanediol butyl ether	59.39
triethyl orthoformate	53.28
p-tert-butyltoluene	27.15
methyl 4-tert-butylbenzoate	84.89
morpholine	244.48
tert-butylamine	54.13
n-dodecanol	17.43
dimethoxymethane	196.82
ethylene carbonate	137.65
cyrene	98.45
2-ethoxyethyl acetate	95.41
2-ethylhexyl acetate	49.95
1,2,4-trichlorobenzene	162.08
4-methylpyridine	168.27
dibutyl ether	46.97
2,6-dimethyl-4-heptanol	23.8
DEF	145.39
dimethyl isosorbide	157.26
tetrachloroethylene	295.27
eugenol	82.25
triacetin	103.59
span 80	55.91
1,4-butanediol	64.59
1,1-dichloroethane	209.68
2-methyl-1-pentanol	51.3
methyl formate	249.57
2-methyl-1-butanol	55.69
n-decane	7.89
butyronitrile	106.93
3,7-dimethyl-1-octanol	31.1
1-chlorooctane	28.64
1-chlorotetradecane	12.43
n-nonane	7.6
undecane	5.9
tert-butylcyclohexane	11.18
cyclooctane	9.37
cyclopentanol	94.48
tetrahydropyran	142.15
tert-amyl methyl ether	71.74
2,5,8-trioxanonane	148.76
1-hexene	37.83
2-isopropoxyethanol	114.13
2,2,2-trifluoroethanol	202.03
methyl butyrate	103.92

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