Molecular formula
C10H20O2

SMILES
CCC1CCCCC1.CC(=O)O

Fragrance
Sweet	44.8%
Woody	32.69%
Dry	31.28%
Gassy	30.42%
Citrus	29.85%
Musk	29.83%
Amber	27.61%
Fresh	20.43%
Clean	20.31%
Animal	19.72%

 

Flavor
Alkane	27.48%
Old paper	20.08%
Terpenic	20.02%
Shrimp	19.91%
Alkaline	19.89%
Beet	19.88%
Soil	19.59%
Tar	18.86%
Rotten	18.82%
Terpentine	18.81%

 

Odor impact est.
Medium

pKa est.
9.79 (weak base)

Molecular weight
172.26 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra fast

Boiling point est.
130°C

Flash point

• 18.9 ˚C est.

• SCHEMBL2485175

Acetic acid;ethylcyclohexane are two chemicals with practical applications across industries. Acetic acid is widely used as a feedstock and solvent in industrial manufacturing, as an acidulant in food processing (e.g., vinegar) and as a precursor for vinyl acetate monomer and acetic anhydride for resins, coatings, and adhesives; it also serves as a solvent and processing aid in coatings, inks, and household cleaning products. Ethylcyclohexane is used as a nonpolar hydrocarbon solvent for coatings, inks, and cleaners, and can serve as an intermediate in the synthesis of cyclic hydrocarbon compounds.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	959.6
methanol	431.79
isopropanol	1156.15
water	0.02
ethyl acetate	3148.22
n-propanol	1248.49
acetone	2322.05
n-butanol	1701.16
acetonitrile	1526.82
DMF	1116.52
toluene	2414.12
isobutanol	1121.67
1,4-dioxane	3885.41
methyl acetate	1939.94
THF	7011.96
2-butanone	2801.62
n-pentanol	1026.19
sec-butanol	1452.89
n-hexane	2773.17
ethylene glycol	44.83
NMP	1488.08
cyclohexane	3413.26
DMSO	1453.03
n-butyl acetate	7813.97
n-octanol	950.51
chloroform	5672.31
n-propyl acetate	2231.66
acetic acid	465.81
dichloromethane	4920.16
cyclohexanone	4392.14
propylene glycol	136.75
isopropyl acetate	2385.61
DMAc	873.61
2-ethoxyethanol	762.37
isopentanol	1725.06
n-heptane	4053.13
ethyl formate	1060.8
1,2-dichloroethane	3595.94
n-hexanol	3185.08
2-methoxyethanol	1051.73
isobutyl acetate	1532.06
tetrachloromethane	1663.94
n-pentyl acetate	1909.82
transcutol	3338.83
n-heptanol	1029.07
ethylbenzene	1049.17
MIBK	2057.26
2-propoxyethanol	2476.85
tert-butanol	2023.56
MTBE	3823.15
2-butoxyethanol	1123.14
propionic acid	747.36
o-xylene	1099.61
formic acid	37.96
diethyl ether	5194.88
m-xylene	1317.9
p-xylene	1180.05
chlorobenzene	2253.98
dimethyl carbonate	360.13
n-octane	934.34
formamide	75.23
cyclopentanone	4025.72
2-pentanone	3050.73
anisole	1356.04
cyclopentyl methyl ether	4265.91
gamma-butyrolactone	3004.25
1-methoxy-2-propanol	1165.91
pyridine	3413.5
3-pentanone	2349.28
furfural	1791.53
n-dodecane	419.11
diethylene glycol	585.58
diisopropyl ether	2115.67
tert-amyl alcohol	1732.78
acetylacetone	1962.93
n-hexadecane	496.6
acetophenone	885.01
methyl propionate	1601.17
isopentyl acetate	5161.9
trichloroethylene	4554.37
n-nonanol	903.49
cyclohexanol	1949.82
benzyl alcohol	565.17
2-ethylhexanol	3218.1
isooctanol	923.34
dipropyl ether	7888.02
1,2-dichlorobenzene	1776.07
ethyl lactate	408.83
propylene carbonate	1948.14
n-methylformamide	436.84
2-pentanol	1643.52
n-pentane	2017.5
1-propoxy-2-propanol	3121.02
1-methoxy-2-propyl acetate	2694.69
2-(2-methoxypropoxy) propanol	803.33
mesitylene	924.27
ε-caprolactone	3168.22
p-cymene	1372.19
epichlorohydrin	3706.7
1,1,1-trichloroethane	4673.32
2-aminoethanol	170.31
morpholine-4-carbaldehyde	1505.63
sulfolane	2588.25
2,2,4-trimethylpentane	640.43
2-methyltetrahydrofuran	6212.29
n-hexyl acetate	2064.99
isooctane	686.82
2-(2-butoxyethoxy)ethanol	1313.61
sec-butyl acetate	1633.81
tert-butyl acetate	2659.56
decalin	960.73
glycerin	146.39
diglyme	2648.08
acrylic acid	391.68
isopropyl myristate	1099.18
n-butyric acid	1931.22
acetyl acetate	1384.77
di(2-ethylhexyl) phthalate	435.78
ethyl propionate	1876.35
nitromethane	915.46
1,2-diethoxyethane	4393.08
benzonitrile	1425.83
trioctyl phosphate	454.52
1-bromopropane	5357.56
gamma-valerolactone	3214.23
n-decanol	699.15
triethyl phosphate	912.19
4-methyl-2-pentanol	1087.66
propionitrile	2207.37
vinylene carbonate	1365.96
1,1,2-trichlorotrifluoroethane	1160.02
DMS	821.95
cumene	646.01
2-octanol	781.97
2-hexanone	2436.0
octyl acetate	1066.84
limonene	2839.26
1,2-dimethoxyethane	2825.41
ethyl orthosilicate	1046.69
tributyl phosphate	653.55
diacetone alcohol	1434.9
N,N-dimethylaniline	747.97
acrylonitrile	1577.65
aniline	1387.95
1,3-propanediol	427.35
bromobenzene	3028.86
dibromomethane	4731.44
1,1,2,2-tetrachloroethane	3994.42
2-methyl-cyclohexyl acetate	1855.34
tetrabutyl urea	793.8
diisobutyl methanol	1841.65
2-phenylethanol	1210.73
styrene	1333.2
dioctyl adipate	952.58
dimethyl sulfate	420.46
ethyl butyrate	4904.65
methyl lactate	320.14
butyl lactate	874.0
diethyl carbonate	1990.42
propanediol butyl ether	574.46
triethyl orthoformate	2673.02
p-tert-butyltoluene	1253.2
methyl 4-tert-butylbenzoate	781.96
morpholine	3961.5
tert-butylamine	2031.42
n-dodecanol	595.08
dimethoxymethane	1474.78
ethylene carbonate	1490.69
cyrene	476.6
2-ethoxyethyl acetate	1560.64
2-ethylhexyl acetate	4511.25
1,2,4-trichlorobenzene	1635.41
4-methylpyridine	3199.45
dibutyl ether	4185.98
2,6-dimethyl-4-heptanol	1841.65
DEF	2348.74
dimethyl isosorbide	1695.69
tetrachloroethylene	2444.06
eugenol	588.7
triacetin	921.98
span 80	922.26
1,4-butanediol	130.19
1,1-dichloroethane	4364.82
2-methyl-1-pentanol	1070.7
methyl formate	338.46
2-methyl-1-butanol	1463.06
n-decane	807.12
butyronitrile	2988.39
3,7-dimethyl-1-octanol	1476.12
1-chlorooctane	1718.92
1-chlorotetradecane	635.96
n-nonane	964.09
undecane	548.42
tert-butylcyclohexane	852.86
cyclooctane	1372.7
cyclopentanol	1692.26
tetrahydropyran	7220.89
tert-amyl methyl ether	2525.91
2,5,8-trioxanonane	1395.13
1-hexene	4375.2
2-isopropoxyethanol	747.7
2,2,2-trifluoroethanol	112.01
methyl butyrate	2416.52

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