Molecular formula
C10H16O3

SMILES
CC1CCC2C(C1)OCC(=O)CO2

Fragrance
Mint	45.65%
Fresh	35.64%
Sweet	35.13%
Herbal	33.66%
Floral	31.62%
Caramellic	31.29%
Woody	30.89%
Green	28.13%
Hay	26.6%
Solvent	26.23%

 

Flavor
Sweet	40.96%
Caramel	37.07%
Bitter	31.39%
Nutty	27.49%
Oily	25.55%
Fatty	25.37%
Coconut	25.08%
Warm	24.95%
Minty	23.7%
Cauliflower	23.68%

 

Odor impact est.
High

XLogP3-AA
1.4

pKa est.
7.46 (neutral)

Molecular weight
184.23 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Slow

Boiling point est.
277°C

Flash point

• 130.22 ˚C est.

• AKOS015842659

7-Methyl-5a,6,7,8,9,9a-hexahydrobenzo[b][1,4]dioxepin-3-one is used as an intermediate in fragrance chemistry and often serves as a fragrance fixative or odor precursor. It may also find use in cosmetics and personal care as a fragrance ingredient or aroma stabilizer; in household products as a fragrance or stability enhancer; in coatings and inks as an odor-stabilizing additive and processing aid; and in polymers and plastics as a processing aid or stabilizer to improve formulation handling. Its applications are typically evaluated within local regulations and formulation constraints.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	258.51
methanol	456.82
isopropanol	137.32
water	5.96
ethyl acetate	254.43
n-propanol	167.98
acetone	411.72
n-butanol	143.23
acetonitrile	321.19
DMF	459.98
toluene	132.8
isobutanol	122.85
1,4-dioxane	481.87
methyl acetate	264.45
THF	523.32
2-butanone	278.48
n-pentanol	93.64
sec-butanol	109.76
n-hexane	4.31
ethylene glycol	141.92
NMP	443.34
cyclohexane	24.12
DMSO	1125.72
n-butyl acetate	188.92
n-octanol	60.05
chloroform	1184.22
n-propyl acetate	165.08
acetic acid	626.37
dichloromethane	1184.1
cyclohexanone	451.64
propylene glycol	106.34
isopropyl acetate	132.22
DMAc	314.78
2-ethoxyethanol	251.04
isopentanol	131.89
n-heptane	6.91
ethyl formate	303.96
1,2-dichloroethane	623.2
n-hexanol	104.03
2-methoxyethanol	404.47
isobutyl acetate	97.93
tetrachloromethane	138.18
n-pentyl acetate	109.22
transcutol	1038.75
n-heptanol	56.03
ethylbenzene	65.18
MIBK	116.39
2-propoxyethanol	218.58
tert-butanol	158.02
MTBE	85.33
2-butoxyethanol	147.7
propionic acid	280.04
o-xylene	98.14
formic acid	416.15
diethyl ether	99.98
m-xylene	89.98
p-xylene	94.46
chlorobenzene	312.72
dimethyl carbonate	106.03
n-octane	3.62
formamide	525.96
cyclopentanone	543.33
2-pentanone	178.81
anisole	177.1
cyclopentyl methyl ether	175.09
gamma-butyrolactone	699.68
1-methoxy-2-propanol	230.95
pyridine	556.37
3-pentanone	133.6
furfural	803.03
n-dodecane	4.12
diethylene glycol	269.4
diisopropyl ether	31.74
tert-amyl alcohol	111.37
acetylacetone	302.73
n-hexadecane	4.81
acetophenone	208.68
methyl propionate	184.59
isopentyl acetate	153.17
trichloroethylene	1280.33
n-nonanol	52.52
cyclohexanol	156.96
benzyl alcohol	185.68
2-ethylhexanol	68.18
isooctanol	51.21
dipropyl ether	60.37
1,2-dichlorobenzene	287.79
ethyl lactate	108.06
propylene carbonate	375.86
n-methylformamide	401.17
2-pentanol	76.13
n-pentane	5.95
1-propoxy-2-propanol	152.42
1-methoxy-2-propyl acetate	188.58
2-(2-methoxypropoxy) propanol	166.37
mesitylene	58.41
ε-caprolactone	378.03
p-cymene	52.96
epichlorohydrin	720.57
1,1,1-trichloroethane	386.49
2-aminoethanol	167.58
morpholine-4-carbaldehyde	481.19
sulfolane	794.85
2,2,4-trimethylpentane	6.64
2-methyltetrahydrofuran	295.7
n-hexyl acetate	149.31
isooctane	5.62
2-(2-butoxyethoxy)ethanol	237.82
sec-butyl acetate	94.69
tert-butyl acetate	133.91
decalin	13.5
glycerin	209.85
diglyme	501.45
acrylic acid	332.35
isopropyl myristate	52.85
n-butyric acid	323.43
acetyl acetate	218.4
di(2-ethylhexyl) phthalate	74.84
ethyl propionate	126.08
nitromethane	915.84
1,2-diethoxyethane	196.35
benzonitrile	289.29
trioctyl phosphate	51.22
1-bromopropane	178.05
gamma-valerolactone	632.36
n-decanol	38.25
triethyl phosphate	80.05
4-methyl-2-pentanol	54.9
propionitrile	190.64
vinylene carbonate	420.49
1,1,2-trichlorotrifluoroethane	556.48
DMS	177.64
cumene	48.91
2-octanol	35.9
2-hexanone	132.85
octyl acetate	70.02
limonene	70.03
1,2-dimethoxyethane	359.15
ethyl orthosilicate	72.96
tributyl phosphate	67.35
diacetone alcohol	174.27
N,N-dimethylaniline	105.83
acrylonitrile	332.16
aniline	229.2
1,3-propanediol	235.46
bromobenzene	309.57
dibromomethane	664.36
1,1,2,2-tetrachloroethane	840.98
2-methyl-cyclohexyl acetate	113.21
tetrabutyl urea	83.15
diisobutyl methanol	46.2
2-phenylethanol	158.59
styrene	96.44
dioctyl adipate	99.37
dimethyl sulfate	212.08
ethyl butyrate	132.0
methyl lactate	145.03
butyl lactate	119.6
diethyl carbonate	108.15
propanediol butyl ether	179.33
triethyl orthoformate	97.92
p-tert-butyltoluene	47.44
methyl 4-tert-butylbenzoate	154.48
morpholine	464.87
tert-butylamine	78.15
n-dodecanol	29.52
dimethoxymethane	217.75
ethylene carbonate	327.11
cyrene	189.36
2-ethoxyethyl acetate	191.86
2-ethylhexyl acetate	115.64
1,2,4-trichlorobenzene	341.94
4-methylpyridine	376.76
dibutyl ether	65.15
2,6-dimethyl-4-heptanol	46.2
DEF	207.18
dimethyl isosorbide	272.4
tetrachloroethylene	589.28
eugenol	152.75
triacetin	204.95
span 80	137.39
1,4-butanediol	101.47
1,1-dichloroethane	420.77
2-methyl-1-pentanol	92.26
methyl formate	367.53
2-methyl-1-butanol	113.55
n-decane	6.1
butyronitrile	174.26
3,7-dimethyl-1-octanol	66.93
1-chlorooctane	40.65
1-chlorotetradecane	16.21
n-nonane	5.3
undecane	4.84
tert-butylcyclohexane	10.05
cyclooctane	8.35
cyclopentanol	194.67
tetrahydropyran	319.41
tert-amyl methyl ether	65.05
2,5,8-trioxanonane	317.79
1-hexene	24.49
2-isopropoxyethanol	153.51
2,2,2-trifluoroethanol	262.35
methyl butyrate	195.02

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