Molecular formula
C7H9NO2S

SMILES
CC1=C(N=CS1)CCOC=O

Fragrance
Nutty	78.56%
Roasted	66.97%
Meaty	50.56%
Popcorn	39.35%
Hazelnut	31.89%
Coffee	31.43%
Cooked	30.2%
Beefy	28.62%
Burnt	26.51%
Cocoa	25.41%

 

Flavor
Fruity	59.04%
Green	39.15%
Nutty	39.03%
Earthy	33.9%
Fatty	31.43%
Floral	30.31%
Musty	28.47%
Vegetable	26.31%
Roasted	24.19%
Spicy	23.5%

 

Odor impact est.
High

XLogP3-AA
1.6

pKa est.
6.08 (neutral)

Molecular weight
171.22 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Slow

Boiling point est.
266°C

Flash point

• 102.67 ˚C est.

2-(5-Methyl-1,3-thiazol-4-yl)ethyl formate is viewed primarily as an intermediate and building block in the synthesis of thiazole-containing compounds with applications in pharmaceuticals and agrochemicals; it is commonly used as an intermediate in routes to functional thiazole derivatives related to drug and pesticide development. It is also considered a precursor for specialized materials systems and components used in coatings, inks, and functional polymers. In organic synthesis, this ester can serve as a protecting group or be converted to other functional groups, and it is often evaluated in the development and optimization of new synthetic routes for industrial chemical production.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	21.84
methanol	42.23
isopropanol	11.28
water	1.89
ethyl acetate	30.98
n-propanol	14.29
acetone	54.05
n-butanol	13.6
acetonitrile	39.26
DMF	217.66
toluene	22.52
isobutanol	10.29
1,4-dioxane	83.43
methyl acetate	48.76
THF	88.38
2-butanone	46.78
n-pentanol	13.17
sec-butanol	11.47
n-hexane	0.5
ethylene glycol	20.8
NMP	255.54
cyclohexane	1.95
DMSO	285.94
n-butyl acetate	25.14
n-octanol	5.54
chloroform	76.65
n-propyl acetate	25.52
acetic acid	78.71
dichloromethane	99.35
cyclohexanone	76.19
propylene glycol	14.62
isopropyl acetate	19.18
DMAc	259.29
2-ethoxyethanol	59.86
isopentanol	14.68
n-heptane	0.86
ethyl formate	37.47
1,2-dichloroethane	67.35
n-hexanol	11.68
2-methoxyethanol	89.42
isobutyl acetate	15.07
tetrachloromethane	12.31
n-pentyl acetate	14.98
transcutol	228.15
n-heptanol	6.82
ethylbenzene	12.05
MIBK	20.46
2-propoxyethanol	42.7
tert-butanol	20.45
MTBE	14.72
2-butoxyethanol	27.85
propionic acid	33.29
o-xylene	22.59
formic acid	99.14
diethyl ether	13.44
m-xylene	16.64
p-xylene	18.29
chlorobenzene	48.96
dimethyl carbonate	30.13
n-octane	0.32
formamide	160.76
cyclopentanone	90.18
2-pentanone	29.55
anisole	50.48
cyclopentyl methyl ether	31.25
gamma-butyrolactone	108.94
1-methoxy-2-propanol	47.85
pyridine	102.91
3-pentanone	28.77
furfural	194.96
n-dodecane	0.34
diethylene glycol	59.72
diisopropyl ether	4.72
tert-amyl alcohol	20.21
acetylacetone	55.38
n-hexadecane	0.41
acetophenone	65.43
methyl propionate	33.35
isopentyl acetate	24.17
trichloroethylene	173.32
n-nonanol	5.86
cyclohexanol	19.11
benzyl alcohol	48.57
2-ethylhexanol	10.14
isooctanol	6.64
dipropyl ether	10.14
1,2-dichlorobenzene	55.35
ethyl lactate	23.94
propylene carbonate	66.89
n-methylformamide	90.81
2-pentanol	7.92
n-pentane	0.57
1-propoxy-2-propanol	29.02
1-methoxy-2-propyl acetate	41.65
2-(2-methoxypropoxy) propanol	52.92
mesitylene	10.06
ε-caprolactone	65.06
p-cymene	10.52
epichlorohydrin	132.4
1,1,1-trichloroethane	46.8
2-aminoethanol	26.65
morpholine-4-carbaldehyde	196.53
sulfolane	184.39
2,2,4-trimethylpentane	0.87
2-methyltetrahydrofuran	55.15
n-hexyl acetate	17.76
isooctane	0.5
2-(2-butoxyethoxy)ethanol	57.42
sec-butyl acetate	17.1
tert-butyl acetate	25.86
decalin	1.65
glycerin	44.81
diglyme	123.72
acrylic acid	55.36
isopropyl myristate	8.55
n-butyric acid	34.13
acetyl acetate	30.36
di(2-ethylhexyl) phthalate	17.69
ethyl propionate	21.69
nitromethane	182.15
1,2-diethoxyethane	39.44
benzonitrile	56.88
trioctyl phosphate	9.01
1-bromopropane	16.73
gamma-valerolactone	153.87
n-decanol	4.58
triethyl phosphate	21.65
4-methyl-2-pentanol	6.64
propionitrile	22.75
vinylene carbonate	74.72
1,1,2-trichlorotrifluoroethane	142.57
DMS	34.71
cumene	9.07
2-octanol	4.04
2-hexanone	26.42
octyl acetate	11.59
limonene	12.68
1,2-dimethoxyethane	96.95
ethyl orthosilicate	18.8
tributyl phosphate	13.04
diacetone alcohol	41.59
N,N-dimethylaniline	39.77
acrylonitrile	45.42
aniline	49.52
1,3-propanediol	33.69
bromobenzene	43.38
dibromomethane	47.22
1,1,2,2-tetrachloroethane	113.92
2-methyl-cyclohexyl acetate	26.4
tetrabutyl urea	20.41
diisobutyl methanol	7.12
2-phenylethanol	33.59
styrene	17.7
dioctyl adipate	20.3
dimethyl sulfate	76.55
ethyl butyrate	24.79
methyl lactate	35.85
butyl lactate	20.19
diethyl carbonate	23.34
propanediol butyl ether	29.16
triethyl orthoformate	22.81
p-tert-butyltoluene	9.39
methyl 4-tert-butylbenzoate	37.34
morpholine	87.67
tert-butylamine	10.1
n-dodecanol	3.61
dimethoxymethane	62.57
ethylene carbonate	48.14
cyrene	71.9
2-ethoxyethyl acetate	35.61
2-ethylhexyl acetate	20.31
1,2,4-trichlorobenzene	76.55
4-methylpyridine	94.35
dibutyl ether	7.39
2,6-dimethyl-4-heptanol	7.12
DEF	62.36
dimethyl isosorbide	90.64
tetrachloroethylene	81.67
eugenol	41.62
triacetin	38.22
span 80	33.14
1,4-butanediol	17.47
1,1-dichloroethane	40.33
2-methyl-1-pentanol	15.15
methyl formate	76.36
2-methyl-1-butanol	12.87
n-decane	0.51
butyronitrile	21.58
3,7-dimethyl-1-octanol	8.73
1-chlorooctane	3.26
1-chlorotetradecane	1.62
n-nonane	0.42
undecane	0.4
tert-butylcyclohexane	1.28
cyclooctane	0.77
cyclopentanol	22.58
tetrahydropyran	37.1
tert-amyl methyl ether	15.79
2,5,8-trioxanonane	98.15
1-hexene	2.82
2-isopropoxyethanol	36.0
2,2,2-trifluoroethanol	55.18
methyl butyrate	33.78

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