Molecular formula
C6H8O3

SMILES
CC1=C(C(=C(O1)C)O)O

Fragrance
Burnt	59.01%
Phenolic	56.32%
Caramellic	45.33%
Smoky	39.01%
Sweet	38.59%
Meaty	31.68%
Spicy	29.39%
Fruity	29.19%
Vanilla	27.72%
Roasted	27.32%

 

Flavor
Sweet	50.45%
Phenolic	47.26%
Smoky	40.89%
Coffee	38.77%
Caramel	38.73%
Burnt	38.12%
Musty	35.5%
Bacon	34.36%
Smoke	33.89%
Meaty	33.22%

 

Odor impact est.
Low

XLogP3-AA
1.1

pKa est.
9.95 (weak base)

Molecular weight
128.13 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
288°C

Flash point

• 96.8 ˚C est.

• furaneol (enol form)
• SCHEMBL13092058
• 2,5-Dimethyl-3,4-dihydroxyfuran

Furaneol (enol form) is widely used as an aroma and flavor compound, providing strawberry-like notes in perfumery, foods and beverages, and confectionery formulations; it is also employed as a fragrance ingredient in cosmetics and personal care products as well as in household products to impart fruity scents; as an aroma chemical, it may serve as a building block or intermediate in fragrance synthesis for industrial applications; use is subject to local regulations and formulation limits.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	449.53
methanol	902.24
isopropanol	287.65
water	162.45
ethyl acetate	110.53
n-propanol	329.64
acetone	254.51
n-butanol	260.22
acetonitrile	153.79
DMF	510.66
toluene	20.27
isobutanol	195.8
1,4-dioxane	385.53
methyl acetate	135.45
THF	553.59
2-butanone	148.85
n-pentanol	179.55
sec-butanol	223.24
n-hexane	28.05
ethylene glycol	286.24
NMP	237.54
cyclohexane	25.1
DMSO	716.44
n-butyl acetate	56.1
n-octanol	76.59
chloroform	126.41
n-propyl acetate	64.17
acetic acid	213.78
dichloromethane	194.35
cyclohexanone	130.34
propylene glycol	152.43
isopropyl acetate	64.55
DMAc	247.79
2-ethoxyethanol	484.9
isopentanol	173.77
n-heptane	24.71
ethyl formate	132.6
1,2-dichloroethane	154.14
n-hexanol	104.39
2-methoxyethanol	770.89
isobutyl acetate	33.64
tetrachloromethane	45.93
n-pentyl acetate	63.34
transcutol	380.12
n-heptanol	75.56
ethylbenzene	24.11
MIBK	85.25
2-propoxyethanol	222.06
tert-butanol	336.27
MTBE	190.86
2-butoxyethanol	142.11
propionic acid	133.96
o-xylene	28.93
formic acid	422.03
diethyl ether	257.49
m-xylene	22.91
p-xylene	28.98
chlorobenzene	33.17
dimethyl carbonate	73.74
n-octane	14.81
formamide	652.15
cyclopentanone	199.5
2-pentanone	131.14
anisole	82.96
cyclopentyl methyl ether	158.64
gamma-butyrolactone	276.28
1-methoxy-2-propanol	397.18
pyridine	99.16
3-pentanone	95.43
furfural	215.58
n-dodecane	9.87
diethylene glycol	260.49
diisopropyl ether	68.14
tert-amyl alcohol	237.96
acetylacetone	117.5
n-hexadecane	10.62
acetophenone	63.56
methyl propionate	111.87
isopentyl acetate	55.38
trichloroethylene	152.7
n-nonanol	68.92
cyclohexanol	124.97
benzyl alcohol	77.31
2-ethylhexanol	56.86
isooctanol	60.1
dipropyl ether	89.37
1,2-dichlorobenzene	44.75
ethyl lactate	54.18
propylene carbonate	101.13
n-methylformamide	388.76
2-pentanol	158.26
n-pentane	38.74
1-propoxy-2-propanol	122.08
1-methoxy-2-propyl acetate	75.32
2-(2-methoxypropoxy) propanol	101.22
mesitylene	20.74
ε-caprolactone	121.82
p-cymene	25.43
epichlorohydrin	315.0
1,1,1-trichloroethane	75.74
2-aminoethanol	360.91
morpholine-4-carbaldehyde	298.09
sulfolane	322.53
2,2,4-trimethylpentane	19.95
2-methyltetrahydrofuran	256.33
n-hexyl acetate	82.27
isooctane	14.43
2-(2-butoxyethoxy)ethanol	156.18
sec-butyl acetate	41.01
tert-butyl acetate	102.04
decalin	13.81
glycerin	269.36
diglyme	300.52
acrylic acid	126.53
isopropyl myristate	38.84
n-butyric acid	140.31
acetyl acetate	49.18
di(2-ethylhexyl) phthalate	33.69
ethyl propionate	65.97
nitromethane	370.25
1,2-diethoxyethane	144.95
benzonitrile	50.17
trioctyl phosphate	32.81
1-bromopropane	90.36
gamma-valerolactone	271.79
n-decanol	51.91
triethyl phosphate	40.86
4-methyl-2-pentanol	81.34
propionitrile	113.7
vinylene carbonate	86.49
1,1,2-trichlorotrifluoroethane	172.62
DMS	62.78
cumene	23.57
2-octanol	59.4
2-hexanone	76.78
octyl acetate	47.66
limonene	35.75
1,2-dimethoxyethane	486.01
ethyl orthosilicate	44.11
tributyl phosphate	35.1
diacetone alcohol	136.89
N,N-dimethylaniline	67.74
acrylonitrile	126.59
aniline	54.85
1,3-propanediol	422.9
bromobenzene	27.55
dibromomethane	123.39
1,1,2,2-tetrachloroethane	124.15
2-methyl-cyclohexyl acetate	48.52
tetrabutyl urea	48.9
diisobutyl methanol	47.64
2-phenylethanol	61.59
styrene	24.65
dioctyl adipate	48.39
dimethyl sulfate	128.21
ethyl butyrate	55.49
methyl lactate	83.39
butyl lactate	54.14
diethyl carbonate	40.95
propanediol butyl ether	109.93
triethyl orthoformate	52.28
p-tert-butyltoluene	27.25
methyl 4-tert-butylbenzoate	85.13
morpholine	386.61
tert-butylamine	214.96
n-dodecanol	39.56
dimethoxymethane	457.03
ethylene carbonate	77.91
cyrene	107.65
2-ethoxyethyl acetate	90.17
2-ethylhexyl acetate	43.12
1,2,4-trichlorobenzene	45.05
4-methylpyridine	74.73
dibutyl ether	72.9
2,6-dimethyl-4-heptanol	47.64
DEF	154.52
dimethyl isosorbide	165.58
tetrachloroethylene	119.29
eugenol	87.57
triacetin	72.3
span 80	76.16
1,4-butanediol	195.97
1,1-dichloroethane	92.89
2-methyl-1-pentanol	117.0
methyl formate	300.69
2-methyl-1-butanol	164.78
n-decane	17.38
butyronitrile	113.91
3,7-dimethyl-1-octanol	58.92
1-chlorooctane	40.85
1-chlorotetradecane	18.6
n-nonane	17.4
undecane	12.64
tert-butylcyclohexane	13.99
cyclooctane	12.4
cyclopentanol	179.62
tetrahydropyran	212.94
tert-amyl methyl ether	145.33
2,5,8-trioxanonane	200.56
1-hexene	56.91
2-isopropoxyethanol	230.85
2,2,2-trifluoroethanol	137.62
methyl butyrate	87.59

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