Molecular formula
C10H10O2

SMILES
CC1C2=C(C=CC=C2OC1=O)C

Fragrance
Sweet	64.58%
Coumarinic	58.05%
Floral	55.67%
Coconut	50.29%
Hay	46.05%
Powdery	43.37%
Phenolic	39.42%
Vanilla	34.07%
Creamy	32.95%
Tobacco	32.3%

 

Flavor
Bitter	55.66%
Herbal	28.28%
Minty	26.15%
Coumarin	23.06%
Tobacco	22.98%
Tonka	22.94%
Spice	22.04%
Woody	21.77%
Lovage	21.69%
Phenolic	21.36%

 

Odor impact est.
High

XLogP3-AA
2.3

pKa est.
7.61 (neutral)

Molecular weight
162.18 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Very slow

Boiling point est.
274°C

Flash point

• 126.91 ˚C est.

• dimethyl benzo-furanone
• SCHEMBL7727599

Dimethyl benzo-furanone is primarily used as a fragrance and aroma intermediate in perfumery and cosmetics, contributing to fruity and floral notes as a constituent or precursor. It is commonly evaluated as a building block in industrial manufacturing for the synthesis of specialty chemicals and fragrance-related formulations. The compound may also function as a fragrance additive in household products and cleaners, as well as in coatings and inks formulations. Its use is subject to local regulations and formulation limits.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	210.96
methanol	351.86
isopropanol	139.7
water	8.0
ethyl acetate	169.65
n-propanol	164.68
acetone	261.68
n-butanol	132.5
acetonitrile	253.36
DMF	502.25
toluene	107.98
isobutanol	109.77
1,4-dioxane	729.07
methyl acetate	205.09
THF	562.82
2-butanone	200.35
n-pentanol	123.34
sec-butanol	114.47
n-hexane	15.79
ethylene glycol	131.25
NMP	321.3
cyclohexane	13.8
DMSO	470.79
n-butyl acetate	127.35
n-octanol	96.29
chloroform	533.03
n-propyl acetate	121.44
acetic acid	165.21
dichloromethane	594.57
cyclohexanone	248.97
propylene glycol	81.41
isopropyl acetate	112.72
DMAc	240.71
2-ethoxyethanol	316.25
isopentanol	109.17
n-heptane	12.1
ethyl formate	155.22
1,2-dichloroethane	377.09
n-hexanol	127.2
2-methoxyethanol	451.08
isobutyl acetate	90.19
tetrachloromethane	87.44
n-pentyl acetate	126.37
transcutol	602.69
n-heptanol	88.82
ethylbenzene	72.79
MIBK	127.93
2-propoxyethanol	350.9
tert-butanol	154.48
MTBE	141.34
2-butoxyethanol	197.79
propionic acid	124.1
o-xylene	69.93
formic acid	132.22
diethyl ether	192.21
m-xylene	86.4
p-xylene	88.06
chlorobenzene	183.79
dimethyl carbonate	136.79
n-octane	10.03
formamide	223.17
cyclopentanone	378.46
2-pentanone	171.82
anisole	197.8
cyclopentyl methyl ether	200.18
gamma-butyrolactone	443.69
1-methoxy-2-propanol	283.18
pyridine	297.25
3-pentanone	134.99
furfural	409.1
n-dodecane	11.5
diethylene glycol	363.55
diisopropyl ether	59.89
tert-amyl alcohol	119.46
acetylacetone	250.99
n-hexadecane	13.14
acetophenone	146.16
methyl propionate	163.63
isopentyl acetate	119.12
trichloroethylene	566.21
n-nonanol	86.2
cyclohexanol	102.04
benzyl alcohol	141.93
2-ethylhexanol	72.04
isooctanol	75.59
dipropyl ether	88.45
1,2-dichlorobenzene	176.3
ethyl lactate	93.46
propylene carbonate	188.12
n-methylformamide	316.14
2-pentanol	87.47
n-pentane	12.9
1-propoxy-2-propanol	172.1
1-methoxy-2-propyl acetate	171.88
2-(2-methoxypropoxy) propanol	173.21
mesitylene	59.84
ε-caprolactone	217.41
p-cymene	44.68
epichlorohydrin	603.27
1,1,1-trichloroethane	241.18
2-aminoethanol	157.3
morpholine-4-carbaldehyde	499.43
sulfolane	429.77
2,2,4-trimethylpentane	9.63
2-methyltetrahydrofuran	291.24
n-hexyl acetate	180.84
isooctane	10.4
2-(2-butoxyethoxy)ethanol	253.6
sec-butyl acetate	86.14
tert-butyl acetate	143.09
decalin	16.86
glycerin	159.68
diglyme	437.88
acrylic acid	134.92
isopropyl myristate	79.78
n-butyric acid	146.5
acetyl acetate	119.07
di(2-ethylhexyl) phthalate	78.17
ethyl propionate	118.5
nitromethane	377.08
1,2-diethoxyethane	194.56
benzonitrile	199.6
trioctyl phosphate	61.58
1-bromopropane	165.4
gamma-valerolactone	511.88
n-decanol	69.36
triethyl phosphate	67.99
4-methyl-2-pentanol	67.12
propionitrile	181.63
vinylene carbonate	213.6
1,1,2-trichlorotrifluoroethane	270.43
DMS	175.37
cumene	55.23
2-octanol	69.59
2-hexanone	133.12
octyl acetate	100.11
limonene	52.35
1,2-dimethoxyethane	414.75
ethyl orthosilicate	65.92
tributyl phosphate	70.32
diacetone alcohol	167.54
N,N-dimethylaniline	120.8
acrylonitrile	264.49
aniline	142.22
1,3-propanediol	205.43
bromobenzene	188.98
dibromomethane	351.0
1,1,2,2-tetrachloroethane	353.88
2-methyl-cyclohexyl acetate	96.95
tetrabutyl urea	90.29
diisobutyl methanol	50.52
2-phenylethanol	147.32
styrene	87.83
dioctyl adipate	96.2
dimethyl sulfate	213.49
ethyl butyrate	96.35
methyl lactate	119.29
butyl lactate	95.95
diethyl carbonate	79.07
propanediol butyl ether	164.98
triethyl orthoformate	79.09
p-tert-butyltoluene	45.4
methyl 4-tert-butylbenzoate	151.08
morpholine	521.91
tert-butylamine	93.99
n-dodecanol	55.56
dimethoxymethane	455.1
ethylene carbonate	176.92
cyrene	160.43
2-ethoxyethyl acetate	187.27
2-ethylhexyl acetate	92.6
1,2,4-trichlorobenzene	182.31
4-methylpyridine	251.88
dibutyl ether	94.26
2,6-dimethyl-4-heptanol	50.52
DEF	176.83
dimethyl isosorbide	267.76
tetrachloroethylene	255.88
eugenol	175.51
triacetin	148.51
span 80	129.22
1,4-butanediol	117.15
1,1-dichloroethane	273.88
2-methyl-1-pentanol	107.49
methyl formate	272.71
2-methyl-1-butanol	103.67
n-decane	16.21
butyronitrile	158.07
3,7-dimethyl-1-octanol	82.04
1-chlorooctane	66.06
1-chlorotetradecane	33.43
n-nonane	14.44
undecane	13.4
tert-butylcyclohexane	17.46
cyclooctane	7.78
cyclopentanol	129.8
tetrahydropyran	296.2
tert-amyl methyl ether	105.15
2,5,8-trioxanonane	298.42
1-hexene	56.73
2-isopropoxyethanol	201.82
2,2,2-trifluoroethanol	107.99
methyl butyrate	135.61

Scent© AI