SMILES
C/C=C/c1cc(O)ccc1O.CC(C)C(O)=O.CC(C)C(O)=O

Fruity	62.74%
Cheesy	47.04%
Caramellic	39.3%
Phenolic	39.06%
Sour	38.58%
Sweet	37.66%
Dairy	35.25%
Creamy	33.92%
Spicy	31.45%
Milky	31.42%

Scent© AI

pKa est.
-304358.72 (strong acid)

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
421°C

Flash point est.
158.54 ˚C

Solvent	Solubility (g/L)
ethanol	134.55
methanol	200.11
isopropanol	115.29
water	15.44
ethyl acetate	24.33
n-propanol	106.71
acetone	104.55
n-butanol	91.32
acetonitrile	44.65
DMF	279.57
toluene	9.38
isobutanol	71.68
1,4-dioxane	131.54
methyl acetate	41.4
THF	173.98
2-butanone	69.94
n-pentanol	74.32
sec-butanol	97.47
n-hexane	7.21
ethylene glycol	51.58
NMP	159.39
cyclohexane	6.69
DMSO	370.49
n-butyl acetate	15.16
n-octanol	33.09
chloroform	52.82
n-propyl acetate	17.54
acetic acid	75.77
dichloromethane	69.75
cyclohexanone	70.13
propylene glycol	69.9
isopropyl acetate	15.63
DMAc	342.82
2-ethoxyethanol	126.62
isopentanol	65.77
n-heptane	4.68
ethyl formate	39.73
1,2-dichloroethane	57.62
n-hexanol	43.36
2-methoxyethanol	182.05
isobutyl acetate	8.83
tetrachloromethane	12.03
n-pentyl acetate	18.73
transcutol	80.91
n-heptanol	39.22
ethylbenzene	11.84
MIBK	23.59
2-propoxyethanol	78.6
tert-butanol	133.54
MTBE	48.46
2-butoxyethanol	68.61
propionic acid	52.3
o-xylene	14.85
formic acid	80.5
diethyl ether	41.29
m-xylene	9.27
p-xylene	15.67
chlorobenzene	9.42
dimethyl carbonate	17.16
n-octane	4.12
formamide	124.24
cyclopentanone	94.2
2-pentanone	45.29
anisole	23.71
cyclopentyl methyl ether	37.22
gamma-butyrolactone	84.15
1-methoxy-2-propanol	110.76
pyridine	44.68
3-pentanone	34.51
furfural	63.7
n-dodecane	2.76
diethylene glycol	82.91
diisopropyl ether	10.47
tert-amyl alcohol	105.53
acetylacetone	35.12
n-hexadecane	2.94
acetophenone	26.78
methyl propionate	29.49
isopentyl acetate	15.73
trichloroethylene	56.54
n-nonanol	30.3
cyclohexanol	50.8
benzyl alcohol	34.35
2-ethylhexanol	21.15
isooctanol	30.19
dipropyl ether	18.25
1,2-dichlorobenzene	12.5
ethyl lactate	20.82
propylene carbonate	32.21
n-methylformamide	114.4
2-pentanol	50.56
n-pentane	6.5
1-propoxy-2-propanol	47.0
1-methoxy-2-propyl acetate	22.35
2-(2-methoxypropoxy) propanol	46.32
mesitylene	7.66
ε-caprolactone	53.38
p-cymene	7.89
epichlorohydrin	101.98
1,1,1-trichloroethane	23.67
2-aminoethanol	94.84
morpholine-4-carbaldehyde	144.37
sulfolane	127.95
2,2,4-trimethylpentane	3.87
2-methyltetrahydrofuran	76.87
n-hexyl acetate	24.55
isooctane	2.08
2-(2-butoxyethoxy)ethanol	65.09
sec-butyl acetate	10.83
tert-butyl acetate	18.84
decalin	4.04
glycerin	83.2
diglyme	95.78
acrylic acid	40.36
isopropyl myristate	10.11
n-butyric acid	47.57
acetyl acetate	12.7
di(2-ethylhexyl) phthalate	15.61
ethyl propionate	15.97
nitromethane	110.34
1,2-diethoxyethane	32.02
benzonitrile	17.06
trioctyl phosphate	13.49
1-bromopropane	32.95
gamma-valerolactone	119.01
n-decanol	22.22
triethyl phosphate	11.43
4-methyl-2-pentanol	25.9
propionitrile	31.34
vinylene carbonate	27.89
1,1,2-trichlorotrifluoroethane	73.86
DMS	16.47
cumene	10.82
2-octanol	25.39
2-hexanone	32.22
octyl acetate	15.16
limonene	10.68
1,2-dimethoxyethane	157.82
ethyl orthosilicate	12.57
tributyl phosphate	11.76
diacetone alcohol	49.42
N,N-dimethylaniline	29.85
acrylonitrile	34.82
aniline	20.05
1,3-propanediol	112.57
bromobenzene	8.1
dibromomethane	42.88
1,1,2,2-tetrachloroethane	70.8
2-methyl-cyclohexyl acetate	15.14
tetrabutyl urea	21.78
diisobutyl methanol	14.25
2-phenylethanol	27.66
styrene	9.71
dioctyl adipate	15.28
dimethyl sulfate	37.9
ethyl butyrate	13.06
methyl lactate	32.92
butyl lactate	22.77
diethyl carbonate	9.18
propanediol butyl ether	53.39
triethyl orthoformate	13.04
p-tert-butyltoluene	7.4
methyl 4-tert-butylbenzoate	31.39
morpholine	157.9
tert-butylamine	61.81
n-dodecanol	16.24
dimethoxymethane	100.92
ethylene carbonate	24.01
cyrene	57.82
2-ethoxyethyl acetate	25.72
2-ethylhexyl acetate	11.98
1,2,4-trichlorobenzene	14.22
4-methylpyridine	36.16
dibutyl ether	16.59
2,6-dimethyl-4-heptanol	14.25
DEF	76.92
dimethyl isosorbide	58.83
tetrachloroethylene	43.83
eugenol	37.28
triacetin	21.38
span 80	39.07
1,4-butanediol	67.26
1,1-dichloroethane	35.14
2-methyl-1-pentanol	58.16
methyl formate	71.77
2-methyl-1-butanol	68.03
n-decane	4.62
butyronitrile	36.88
3,7-dimethyl-1-octanol	23.65
1-chlorooctane	13.07
1-chlorotetradecane	5.33
n-nonane	4.37
undecane	3.43
tert-butylcyclohexane	3.7
cyclooctane	3.7
cyclopentanol	68.73
tetrahydropyran	73.3
tert-amyl methyl ether	42.12
2,5,8-trioxanonane	77.64
1-hexene	18.51
2-isopropoxyethanol	70.43
2,2,2-trifluoroethanol	40.06
methyl butyrate	26.13

Scent© AI