Molecular formula
C10H20O2

SMILES
CCCC[C@H](CC)CCC(=O)O

Fragrance
Fatty	82.3%
Cheesy	63.57%
Waxy	61.93%
Dairy	54.72%
Milky	47.42%
Sour	44.91%
Oily	43.7%
Creamy	42.11%
Sweaty	40.77%
Citrus	34.93%

 

Flavor
Fatty	60.49%
Waxy	51.42%
Cheese	41.01%
Oily	39.97%
Fat	35.58%
Green	31.92%
Creamy	29.88%
Coconut	28.93%
Mild	27.93%
Sour	27.51%

 

Odor impact est.
Medium

XLogP3-AA
3.6

pKa est.
8.27 (weak base)

Molecular weight
172.26 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
260°C

Flash point

• 119.75 ˚C est.

• (S)-4-Ethyloctanoic acid
• (4S)-4-ethyloctanoic acid

As a chiral long-chain fatty acid, (S)-4-Ethyloctanoic acid is commonly used as a chiral building block and synthetic intermediate in pharmaceutical and agrochemical manufacture; it serves as a precursor for the preparation of esters and amides, and can function as a specialty lubricant, plasticizer, or polymer modifier; in cosmetics and personal care it can be esterified to form emollient esters or used as an intermediate in formulations; it may be used to synthesize fragrance materials or aroma esters for cosmetics and fragrances; and it can be employed as a fatty-acid-derived component in surfactants or as an additive for coatings, inks, and cleaning products.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	3848.64
methanol	4099.83
isopropanol	3481.54
water	0.23
ethyl acetate	1567.54
n-propanol	2820.8
acetone	3646.96
n-butanol	2362.5
acetonitrile	935.22
DMF	3137.24
toluene	334.04
isobutanol	2016.96
1,4-dioxane	1811.78
methyl acetate	982.36
THF	4683.68
2-butanone	2025.9
n-pentanol	1625.17
sec-butanol	2045.04
n-hexane	265.35
ethylene glycol	400.58
NMP	1796.79
cyclohexane	146.91
DMSO	4105.83
n-butyl acetate	1461.46
n-octanol	447.99
chloroform	1073.43
n-propyl acetate	1133.87
acetic acid	1085.21
dichloromethane	1149.38
cyclohexanone	2619.36
propylene glycol	851.2
isopropyl acetate	1218.67
DMAc	1296.18
2-ethoxyethanol	1413.65
isopentanol	2024.8
n-heptane	79.85
ethyl formate	783.11
1,2-dichloroethane	1120.24
n-hexanol	1730.53
2-methoxyethanol	2729.46
isobutyl acetate	707.14
tetrachloromethane	218.6
n-pentyl acetate	627.23
transcutol	3223.21
n-heptanol	557.61
ethylbenzene	228.02
MIBK	1230.54
2-propoxyethanol	2059.68
tert-butanol	3753.09
MTBE	2190.4
2-butoxyethanol	901.15
propionic acid	1148.96
o-xylene	239.47
formic acid	298.92
diethyl ether	1363.51
m-xylene	353.0
p-xylene	288.07
chlorobenzene	437.86
dimethyl carbonate	228.43
n-octane	29.89
formamide	517.61
cyclopentanone	3344.51
2-pentanone	2153.39
anisole	533.82
cyclopentyl methyl ether	1937.59
gamma-butyrolactone	2594.07
1-methoxy-2-propanol	2515.82
pyridine	1111.91
3-pentanone	857.81
furfural	1288.35
n-dodecane	19.8
diethylene glycol	1040.78
diisopropyl ether	483.38
tert-amyl alcohol	2190.59
acetylacetone	1570.14
n-hexadecane	23.22
acetophenone	442.52
methyl propionate	980.54
isopentyl acetate	1283.69
trichloroethylene	1576.09
n-nonanol	367.03
cyclohexanol	1520.88
benzyl alcohol	503.14
2-ethylhexanol	794.65
isooctanol	457.13
dipropyl ether	804.77
1,2-dichlorobenzene	381.83
ethyl lactate	333.52
propylene carbonate	1044.71
n-methylformamide	1530.74
2-pentanol	1547.17
n-pentane	117.64
1-propoxy-2-propanol	1559.28
1-methoxy-2-propyl acetate	1145.31
2-(2-methoxypropoxy) propanol	597.92
mesitylene	223.7
ε-caprolactone	1671.82
p-cymene	158.37
epichlorohydrin	2538.59
1,1,1-trichloroethane	886.93
2-aminoethanol	1254.53
morpholine-4-carbaldehyde	1542.58
sulfolane	2912.39
2,2,4-trimethylpentane	72.97
2-methyltetrahydrofuran	3249.52
n-hexyl acetate	825.56
isooctane	76.66
2-(2-butoxyethoxy)ethanol	999.8
sec-butyl acetate	725.64
tert-butyl acetate	1273.29
decalin	90.32
glycerin	715.9
diglyme	1600.13
acrylic acid	624.93
isopropyl myristate	246.62
n-butyric acid	2177.15
acetyl acetate	520.5
di(2-ethylhexyl) phthalate	231.01
ethyl propionate	778.74
nitromethane	1547.87
1,2-diethoxyethane	1184.89
benzonitrile	580.12
trioctyl phosphate	208.34
1-bromopropane	735.5
gamma-valerolactone	2878.42
n-decanol	267.84
triethyl phosphate	202.86
4-methyl-2-pentanol	822.14
propionitrile	969.41
vinylene carbonate	709.76
1,1,2-trichlorotrifluoroethane	1131.88
DMS	378.36
cumene	174.02
2-octanol	382.0
2-hexanone	1381.82
octyl acetate	330.42
limonene	312.35
1,2-dimethoxyethane	2034.93
ethyl orthosilicate	226.49
tributyl phosphate	252.15
diacetone alcohol	1574.98
N,N-dimethylaniline	339.35
acrylonitrile	919.02
aniline	656.35
1,3-propanediol	1662.41
bromobenzene	428.18
dibromomethane	857.84
1,1,2,2-tetrachloroethane	1355.58
2-methyl-cyclohexyl acetate	487.33
tetrabutyl urea	314.98
diisobutyl methanol	391.42
2-phenylethanol	617.45
styrene	272.12
dioctyl adipate	351.64
dimethyl sulfate	404.52
ethyl butyrate	759.51
methyl lactate	477.03
butyl lactate	506.14
diethyl carbonate	326.16
propanediol butyl ether	855.28
triethyl orthoformate	418.56
p-tert-butyltoluene	171.69
methyl 4-tert-butylbenzoate	435.64
morpholine	3036.75
tert-butylamine	1992.23
n-dodecanol	188.84
dimethoxymethane	1534.04
ethylene carbonate	678.32
cyrene	485.37
2-ethoxyethyl acetate	717.38
2-ethylhexyl acetate	864.55
1,2,4-trichlorobenzene	436.24
4-methylpyridine	1234.83
dibutyl ether	546.62
2,6-dimethyl-4-heptanol	391.42
DEF	1742.35
dimethyl isosorbide	939.41
tetrachloroethylene	875.38
eugenol	449.25
triacetin	475.2
span 80	606.98
1,4-butanediol	632.46
1,1-dichloroethane	1194.74
2-methyl-1-pentanol	1203.78
methyl formate	705.19
2-methyl-1-butanol	1589.66
n-decane	38.57
butyronitrile	1390.59
3,7-dimethyl-1-octanol	508.23
1-chlorooctane	225.4
1-chlorotetradecane	67.36
n-nonane	38.5
undecane	26.75
tert-butylcyclohexane	110.3
cyclooctane	44.46
cyclopentanol	2066.87
tetrahydropyran	2807.46
tert-amyl methyl ether	1144.0
2,5,8-trioxanonane	900.11
1-hexene	965.02
2-isopropoxyethanol	1041.43
2,2,2-trifluoroethanol	228.86
methyl butyrate	1251.59

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