Molecular formula
C14H19N3O2

SMILES
CCC1=CC=CC=C1NC(=O)C/C(=N\NC(=O)C)/C

Fragrance
Meaty	41.41%
Savory	33.28%
Roasted	31.09%
Odorless	28.82%
Grape	28.7%
Fruity	28.36%
Cooked	27.62%
Citrus	26.02%
Grapefruit	25.92%
Cooling	24.37%

 

Flavor
Odorless	34.1%
Roasted	30.15%
Mild	27.31%
Cooked	25.41%
Nutty	22.7%
Fruity	21.52%
Taco	20.84%
Roast	20.29%
Roasted peanuts	20.29%
Bread crust	20.08%

 

Odor impact est.
Odorless

XLogP3-AA
1.0

pKa est.
8.16 (weak base)

Molecular weight
261.32 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
426°C

Flash point

• 210.72 ˚C est.

Presented as (3Z)-3-(acetylhydrazinylidene)-N-(2-ethylphenyl)butanamide, practical applications are mainly as an intermediate in pharmaceutical synthesis; a versatile building block in organic synthesis for constructing hydrazone and imine motifs; a precursor for hydrazone-based dyes and pigments in materials science; and may be employed as a functional monomer or precursor in polymer and coating development.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	20.62
methanol	33.17
isopropanol	9.68
water	0.09
ethyl acetate	5.76
n-propanol	12.83
acetone	35.01
n-butanol	10.98
acetonitrile	9.5
DMF	162.43
toluene	0.72
isobutanol	8.55
1,4-dioxane	10.39
methyl acetate	11.64
THF	50.23
2-butanone	23.82
n-pentanol	10.97
sec-butanol	8.98
n-hexane	0.13
ethylene glycol	6.93
NMP	82.6
cyclohexane	0.05
DMSO	228.51
n-butyl acetate	8.79
n-octanol	2.99
chloroform	37.83
n-propyl acetate	6.63
acetic acid	33.52
dichloromethane	35.99
cyclohexanone	24.94
propylene glycol	16.2
isopropyl acetate	4.48
DMAc	238.38
2-ethoxyethanol	32.92
isopentanol	10.48
n-heptane	0.04
ethyl formate	11.44
1,2-dichloroethane	17.25
n-hexanol	5.96
2-methoxyethanol	57.91
isobutyl acetate	5.73
tetrachloromethane	1.68
n-pentyl acetate	4.37
transcutol	78.54
n-heptanol	2.98
ethylbenzene	1.52
MIBK	9.41
2-propoxyethanol	32.25
tert-butanol	9.96
MTBE	4.34
2-butoxyethanol	15.39
propionic acid	14.61
o-xylene	1.08
formic acid	24.33
diethyl ether	2.29
m-xylene	0.92
p-xylene	2.53
chlorobenzene	5.4
dimethyl carbonate	8.07
n-octane	0.04
formamide	28.08
cyclopentanone	45.55
2-pentanone	11.35
anisole	9.34
cyclopentyl methyl ether	5.71
gamma-butyrolactone	40.53
1-methoxy-2-propanol	34.72
pyridine	14.29
3-pentanone	7.51
furfural	51.14
n-dodecane	0.07
diethylene glycol	31.61
diisopropyl ether	0.57
tert-amyl alcohol	9.32
acetylacetone	19.21
n-hexadecane	0.08
acetophenone	14.04
methyl propionate	9.13
isopentyl acetate	10.93
trichloroethylene	50.2
n-nonanol	3.0
cyclohexanol	4.45
benzyl alcohol	13.13
2-ethylhexanol	3.67
isooctanol	2.9
dipropyl ether	1.83
1,2-dichlorobenzene	7.85
ethyl lactate	10.33
propylene carbonate	21.19
n-methylformamide	36.36
2-pentanol	3.71
n-pentane	0.04
1-propoxy-2-propanol	18.33
1-methoxy-2-propyl acetate	16.32
2-(2-methoxypropoxy) propanol	26.79
mesitylene	0.69
ε-caprolactone	20.26
p-cymene	1.43
epichlorohydrin	56.81
1,1,1-trichloroethane	9.61
2-aminoethanol	16.47
morpholine-4-carbaldehyde	60.42
sulfolane	78.44
2,2,4-trimethylpentane	0.12
2-methyltetrahydrofuran	15.31
n-hexyl acetate	7.57
isooctane	0.07
2-(2-butoxyethoxy)ethanol	28.04
sec-butyl acetate	4.42
tert-butyl acetate	6.76
decalin	0.17
glycerin	29.92
diglyme	47.87
acrylic acid	17.45
isopropyl myristate	2.98
n-butyric acid	16.64
acetyl acetate	5.74
di(2-ethylhexyl) phthalate	8.2
ethyl propionate	6.22
nitromethane	54.91
1,2-diethoxyethane	9.22
benzonitrile	11.65
trioctyl phosphate	3.92
1-bromopropane	4.64
gamma-valerolactone	61.38
n-decanol	2.13
triethyl phosphate	7.29
4-methyl-2-pentanol	3.24
propionitrile	7.66
vinylene carbonate	19.15
1,1,2-trichlorotrifluoroethane	66.3
DMS	10.74
cumene	1.7
2-octanol	1.72
2-hexanone	11.37
octyl acetate	4.21
limonene	1.61
1,2-dimethoxyethane	45.49
ethyl orthosilicate	6.24
tributyl phosphate	6.04
diacetone alcohol	18.9
N,N-dimethylaniline	8.16
acrylonitrile	13.37
aniline	4.95
1,3-propanediol	23.23
bromobenzene	4.23
dibromomethane	15.62
1,1,2,2-tetrachloroethane	39.44
2-methyl-cyclohexyl acetate	9.85
tetrabutyl urea	9.86
diisobutyl methanol	2.09
2-phenylethanol	10.9
styrene	1.88
dioctyl adipate	7.77
dimethyl sulfate	26.76
ethyl butyrate	6.61
methyl lactate	16.14
butyl lactate	9.71
diethyl carbonate	6.07
propanediol butyl ether	19.21
triethyl orthoformate	6.48
p-tert-butyltoluene	1.23
methyl 4-tert-butylbenzoate	14.65
morpholine	20.69
tert-butylamine	3.1
n-dodecanol	1.5
dimethoxymethane	31.21
ethylene carbonate	12.36
cyrene	29.41
2-ethoxyethyl acetate	10.06
2-ethylhexyl acetate	7.53
1,2,4-trichlorobenzene	11.89
4-methylpyridine	15.09
dibutyl ether	2.55
2,6-dimethyl-4-heptanol	2.09
DEF	18.44
dimethyl isosorbide	40.86
tetrachloroethylene	16.69
eugenol	18.97
triacetin	13.16
span 80	15.93
1,4-butanediol	10.73
1,1-dichloroethane	10.92
2-methyl-1-pentanol	11.14
methyl formate	23.92
2-methyl-1-butanol	9.77
n-decane	0.1
butyronitrile	9.42
3,7-dimethyl-1-octanol	3.88
1-chlorooctane	1.02
1-chlorotetradecane	0.42
n-nonane	0.08
undecane	0.08
tert-butylcyclohexane	0.2
cyclooctane	0.02
cyclopentanol	8.32
tetrahydropyran	6.4
tert-amyl methyl ether	4.15
2,5,8-trioxanonane	36.97
1-hexene	1.15
2-isopropoxyethanol	17.38
2,2,2-trifluoroethanol	13.38
methyl butyrate	10.55

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