Molecular formula
C12H16O5

SMILES
CC(=O)OC1=C(C=C(C=C1)C(OC)OC)OC

Fragrance
Floral	70.35%
Sweet	69.78%
Vanilla	61.84%
Spicy	46.29%
Powdery	44.84%
Balsamic	39.27%
Creamy	35.19%
Fresh	35.18%
Phenolic	33.83%
Woody	32.18%

 

Flavor
Fruity	50.46%
Sweet	43.54%
Bitter	43.49%
Woody	36.31%
Floral	29.47%
Creamy	28.71%
Powdery	27.0%
Musty	26.82%
Spicy	25.72%
Spice	25.49%

 

Odor impact est.
Medium

XLogP3-AA
1.3

pKa est.
6.25 (neutral)

Molecular weight
240.25 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
304°C

Flash point

• 125.0 ˚C est.

• SCHEMBL4964245

[4-(Dimethoxymethyl)-2-methoxyphenyl] acetate is an aryl acetate derivative commonly considered a fragrance-related chemical. In perfumery, it may serve as an odorant component or a fixative in various fragrance formulations. In cosmetics and personal care, it is often evaluated as a fragrance ingredient or aroma compound integrated into creams, lotions, and hair care products. In cleaning and household products, it may be used as a fragrance additive to impart and stabilize scent in detergents and cleaners and fabric softeners. In coatings and inks, it can be incorporated as a fragrance additive or intermediate for scent-enriched formulations. In industrial manufacturing, it may act as an intermediate or precursor in the synthesis of other aroma-related esters or specialty chemicals used in fragrance supply chains, subject to local regulations and formulation limits.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	170.58
methanol	270.91
isopropanol	120.05
water	11.83
ethyl acetate	370.76
n-propanol	117.04
acetone	494.69
n-butanol	98.55
acetonitrile	474.46
DMF	716.23
toluene	89.71
isobutanol	95.01
1,4-dioxane	410.01
methyl acetate	339.07
THF	569.28
2-butanone	226.82
n-pentanol	86.19
sec-butanol	108.9
n-hexane	11.7
ethylene glycol	118.88
NMP	660.06
cyclohexane	21.98
DMSO	853.62
n-butyl acetate	157.69
n-octanol	44.49
chloroform	800.76
n-propyl acetate	207.38
acetic acid	831.2
dichloromethane	983.67
cyclohexanone	339.94
propylene glycol	67.12
isopropyl acetate	181.58
DMAc	720.41
2-ethoxyethanol	340.61
isopentanol	96.98
n-heptane	9.99
ethyl formate	242.25
1,2-dichloroethane	531.14
n-hexanol	68.35
2-methoxyethanol	491.19
isobutyl acetate	123.51
tetrachloromethane	106.71
n-pentyl acetate	82.88
transcutol	369.66
n-heptanol	39.93
ethylbenzene	70.08
MIBK	123.03
2-propoxyethanol	208.73
tert-butanol	247.86
MTBE	203.86
2-butoxyethanol	109.77
propionic acid	244.53
o-xylene	89.18
formic acid	511.73
diethyl ether	208.84
m-xylene	73.4
p-xylene	95.77
chlorobenzene	174.3
dimethyl carbonate	254.68
n-octane	5.68
formamide	714.63
cyclopentanone	436.91
2-pentanone	195.43
anisole	186.38
cyclopentyl methyl ether	248.93
gamma-butyrolactone	647.85
1-methoxy-2-propanol	261.18
pyridine	315.19
3-pentanone	179.75
furfural	578.72
n-dodecane	5.32
diethylene glycol	232.46
diisopropyl ether	60.14
tert-amyl alcohol	196.9
acetylacetone	370.42
n-hexadecane	6.11
acetophenone	217.29
methyl propionate	289.43
isopentyl acetate	138.6
trichloroethylene	973.75
n-nonanol	42.21
cyclohexanol	140.94
benzyl alcohol	149.15
2-ethylhexanol	56.77
isooctanol	36.93
dipropyl ether	93.13
1,2-dichlorobenzene	197.63
ethyl lactate	120.77
propylene carbonate	347.63
n-methylformamide	389.18
2-pentanol	72.67
n-pentane	11.1
1-propoxy-2-propanol	124.38
1-methoxy-2-propyl acetate	176.24
2-(2-methoxypropoxy) propanol	127.88
mesitylene	49.34
ε-caprolactone	330.48
p-cymene	45.18
epichlorohydrin	647.04
1,1,1-trichloroethane	405.28
2-aminoethanol	138.4
morpholine-4-carbaldehyde	617.52
sulfolane	682.79
2,2,4-trimethylpentane	11.8
2-methyltetrahydrofuran	354.07
n-hexyl acetate	105.36
isooctane	5.52
2-(2-butoxyethoxy)ethanol	135.0
sec-butyl acetate	136.09
tert-butyl acetate	197.77
decalin	17.0
glycerin	173.11
diglyme	359.56
acrylic acid	303.28
isopropyl myristate	48.56
n-butyric acid	267.34
acetyl acetate	389.06
di(2-ethylhexyl) phthalate	57.58
ethyl propionate	194.16
nitromethane	1397.62
1,2-diethoxyethane	151.73
benzonitrile	188.1
trioctyl phosphate	40.13
1-bromopropane	176.7
gamma-valerolactone	557.71
n-decanol	31.9
triethyl phosphate	107.56
4-methyl-2-pentanol	50.23
propionitrile	214.0
vinylene carbonate	370.55
1,1,2-trichlorotrifluoroethane	585.6
DMS	180.21
cumene	52.88
2-octanol	30.67
2-hexanone	144.2
octyl acetate	61.32
limonene	63.63
1,2-dimethoxyethane	506.61
ethyl orthosilicate	95.84
tributyl phosphate	58.24
diacetone alcohol	194.85
N,N-dimethylaniline	145.63
acrylonitrile	293.55
aniline	154.75
1,3-propanediol	193.59
bromobenzene	179.26
dibromomethane	478.5
1,1,2,2-tetrachloroethane	667.16
2-methyl-cyclohexyl acetate	118.14
tetrabutyl urea	75.69
diisobutyl methanol	37.88
2-phenylethanol	112.17
styrene	85.53
dioctyl adipate	86.54
dimethyl sulfate	438.63
ethyl butyrate	150.36
methyl lactate	156.94
butyl lactate	69.44
diethyl carbonate	137.43
propanediol butyl ether	82.3
triethyl orthoformate	115.76
p-tert-butyltoluene	44.76
methyl 4-tert-butylbenzoate	137.84
morpholine	443.7
tert-butylamine	131.3
n-dodecanol	25.7
dimethoxymethane	482.9
ethylene carbonate	287.65
cyrene	194.43
2-ethoxyethyl acetate	133.08
2-ethylhexyl acetate	114.79
1,2,4-trichlorobenzene	240.19
4-methylpyridine	295.76
dibutyl ether	65.08
2,6-dimethyl-4-heptanol	37.88
DEF	313.71
dimethyl isosorbide	247.32
tetrachloroethylene	448.26
eugenol	118.6
triacetin	170.66
span 80	84.85
1,4-butanediol	90.95
1,1-dichloroethane	399.93
2-methyl-1-pentanol	89.15
methyl formate	408.9
2-methyl-1-butanol	96.32
n-decane	8.61
butyronitrile	181.75
3,7-dimethyl-1-octanol	46.02
1-chlorooctane	36.84
1-chlorotetradecane	17.11
n-nonane	8.08
undecane	6.48
tert-butylcyclohexane	14.28
cyclooctane	8.09
cyclopentanol	173.39
tetrahydropyran	273.15
tert-amyl methyl ether	165.14
2,5,8-trioxanonane	224.75
1-hexene	43.22
2-isopropoxyethanol	201.0
2,2,2-trifluoroethanol	471.11
methyl butyrate	245.94

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