Molecular formula
C9H18NO3+

SMILES
C[N+](C)(C)CC(COC(=O)C=C)O

Fragrance
Fruity	49.85%
Sweet	29.06%
Buttery	28.16%
Odorless	26.34%
Creamy	22.91%
Caramellic	22.41%
Sour	22.2%
Milky	22.18%
Fatty	22.1%
Grape	20.21%

 

Flavor
Fruity	35.12%
Odorless	31.08%
Bitter	27.1%
Bland	25.44%
Mild	24.71%
Sweet-like	19.08%
Heather	19.06%
Grape skin	19.02%
Stinky	18.99%
Dried berry	18.9%

 

Odor impact est.
Low

XLogP3-AA
0.0

pKa est.
6.32 (neutral)

Molecular weight
188.24 g/mol

Flash point

• -86.84 ˚C est.

• SCHEMBL5672906

The compound, (2-Hydroxy-3-prop-2-enoyloxypropyl)-trimethylazanium, is a quaternary ammonium ester derived from a glyceryl acrylate with potential surfactant and polymerizable monomer functionality. In practice, it is used as a cationic surfactant and emulsifier in cosmetics and household cleaners to improve wetting, dispersion, and emulsion stability. It can also serve as a reactive comonomer or functional additive in coatings, inks, and adhesives to enhance adhesion, pigment dispersion, and polymerization performance. In the polymer industry, it may be used as an intermediate to synthesize quaternary ammonium polymers or as a rheology modifier in various polymer matrices. Additionally, it can act as a specialized additive in polymerizable systems and as a processing aid in plastics, contributing to film formation and surface properties.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	177.72
methanol	456.54
isopropanol	29.9
water	145.79
ethyl acetate	10.09
n-propanol	72.69
acetone	11.98
n-butanol	33.29
acetonitrile	11.02
DMF	94.92
toluene	2.84
isobutanol	24.51
1,4-dioxane	16.39
methyl acetate	17.38
THF	25.03
2-butanone	10.78
n-pentanol	9.24
sec-butanol	23.04
n-hexane	0.57
ethylene glycol	204.88
NMP	183.23
cyclohexane	1.04
DMSO	70.12
n-butyl acetate	12.52
n-octanol	6.46
chloroform	37.9
n-propyl acetate	7.47
acetic acid	645.79
dichloromethane	30.79
cyclohexanone	25.25
propylene glycol	161.44
isopropyl acetate	4.47
DMAc	108.54
2-ethoxyethanol	52.1
isopentanol	11.41
n-heptane	0.8
ethyl formate	38.54
1,2-dichloroethane	15.19
n-hexanol	17.28
2-methoxyethanol	204.47
isobutyl acetate	4.57
tetrachloromethane	8.39
n-pentyl acetate	5.93
transcutol	110.6
n-heptanol	8.35
ethylbenzene	2.23
MIBK	3.59
2-propoxyethanol	55.71
tert-butanol	19.18
MTBE	4.09
2-butoxyethanol	29.68
propionic acid	150.01
o-xylene	4.18
formic acid	1191.35
diethyl ether	3.38
m-xylene	3.3
p-xylene	2.92
chlorobenzene	7.47
dimethyl carbonate	13.53
n-octane	0.28
formamide	498.25
cyclopentanone	30.69
2-pentanone	5.46
anisole	7.19
cyclopentyl methyl ether	9.71
gamma-butyrolactone	78.35
1-methoxy-2-propanol	54.24
pyridine	21.62
3-pentanone	5.72
furfural	120.03
n-dodecane	0.22
diethylene glycol	104.08
diisopropyl ether	0.78
tert-amyl alcohol	20.54
acetylacetone	9.97
n-hexadecane	0.23
acetophenone	14.45
methyl propionate	16.6
isopentyl acetate	11.02
trichloroethylene	51.22
n-nonanol	6.02
cyclohexanol	20.69
benzyl alcohol	17.65
2-ethylhexanol	8.38
isooctanol	5.88
dipropyl ether	3.75
1,2-dichlorobenzene	11.03
ethyl lactate	21.94
propylene carbonate	57.33
n-methylformamide	147.87
2-pentanol	7.17
n-pentane	0.7
1-propoxy-2-propanol	28.08
1-methoxy-2-propyl acetate	19.21
2-(2-methoxypropoxy) propanol	37.85
mesitylene	2.32
ε-caprolactone	44.04
p-cymene	4.14
epichlorohydrin	45.41
1,1,1-trichloroethane	11.4
2-aminoethanol	234.61
morpholine-4-carbaldehyde	123.19
sulfolane	117.8
2,2,4-trimethylpentane	0.76
2-methyltetrahydrofuran	16.35
n-hexyl acetate	9.86
isooctane	0.34
2-(2-butoxyethoxy)ethanol	42.43
sec-butyl acetate	3.63
tert-butyl acetate	6.47
decalin	0.74
glycerin	276.91
diglyme	60.46
acrylic acid	213.33
isopropyl myristate	3.07
n-butyric acid	93.21
acetyl acetate	12.75
di(2-ethylhexyl) phthalate	12.72
ethyl propionate	6.82
nitromethane	214.55
1,2-diethoxyethane	6.17
benzonitrile	10.97
trioctyl phosphate	7.54
1-bromopropane	4.94
gamma-valerolactone	82.51
n-decanol	4.12
triethyl phosphate	11.46
4-methyl-2-pentanol	3.61
propionitrile	9.56
vinylene carbonate	63.98
1,1,2-trichlorotrifluoroethane	202.38
DMS	16.53
cumene	2.48
2-octanol	3.23
2-hexanone	4.36
octyl acetate	5.72
limonene	5.5
1,2-dimethoxyethane	27.77
ethyl orthosilicate	9.66
tributyl phosphate	9.41
diacetone alcohol	20.98
N,N-dimethylaniline	7.76
acrylonitrile	20.99
aniline	15.65
1,3-propanediol	180.1
bromobenzene	4.85
dibromomethane	15.82
1,1,2,2-tetrachloroethane	38.62
2-methyl-cyclohexyl acetate	14.69
tetrabutyl urea	12.56
diisobutyl methanol	3.68
2-phenylethanol	19.63
styrene	2.37
dioctyl adipate	9.54
dimethyl sulfate	37.48
ethyl butyrate	9.51
methyl lactate	44.56
butyl lactate	20.57
diethyl carbonate	9.54
propanediol butyl ether	41.51
triethyl orthoformate	9.46
p-tert-butyltoluene	4.03
methyl 4-tert-butylbenzoate	22.78
morpholine	40.93
tert-butylamine	8.45
n-dodecanol	2.85
dimethoxymethane	22.08
ethylene carbonate	39.19
cyrene	55.93
2-ethoxyethyl acetate	12.92
2-ethylhexyl acetate	8.96
1,2,4-trichlorobenzene	17.86
4-methylpyridine	14.73
dibutyl ether	2.08
2,6-dimethyl-4-heptanol	3.68
DEF	19.62
dimethyl isosorbide	53.17
tetrachloroethylene	41.39
eugenol	29.18
triacetin	21.91
span 80	33.19
1,4-butanediol	42.5
1,1-dichloroethane	8.03
2-methyl-1-pentanol	6.8
methyl formate	104.58
2-methyl-1-butanol	18.46
n-decane	0.35
butyronitrile	6.91
3,7-dimethyl-1-octanol	6.16
1-chlorooctane	1.97
1-chlorotetradecane	0.75
n-nonane	0.32
undecane	0.27
tert-butylcyclohexane	0.72
cyclooctane	0.44
cyclopentanol	28.44
tetrahydropyran	9.64
tert-amyl methyl ether	5.73
2,5,8-trioxanonane	46.9
1-hexene	1.5
2-isopropoxyethanol	18.7
2,2,2-trifluoroethanol	259.77
methyl butyrate	11.67

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