Molecular formula
C15H29O5-

SMILES
CCCCCCCCCC(=O)CC(=O)O.CC(CO)[O-]

Fragrance
Fatty	77.63%
Waxy	55.92%
Dairy	48.11%
Milky	43.32%
Creamy	38.99%
Cheesy	36.85%
Oily	35.74%
Buttery	32.77%
Lactonic	32.35%
Peach	29.13%

 

Flavor
Fatty	60.82%
Waxy	47.69%
Cheese	41.83%
Oily	38.45%
Fruity	35.39%
Green	33.05%
Fat	32.27%
Creamy	31.43%
Sour	29.42%
Sweat	28.31%

 

Odor impact est.
Low

pKa est.
7.06 (neutral)

Molecular weight
289.39 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
316°C

Flash point

• 160.65 ˚C est.

1-Hydroxypropan-2-olate;3-oxododecanoic acid is typically viewed as an intermediate in organic synthesis and a building block for specialty esters and long-chain polymers. In practice, it may be employed as a precursor for custom ester formulations and as a monomer or compatibilizer in polymer synthesis. It can serve as a reactive intermediate or additive in coatings, inks, and adhesives formulations. The long aliphatic chain and keto functionality may support use as a lubricant component or lubricant additive in some formulations. In fragrance chemistry, it may be evaluated as a precursor for fragrance materials or as a potential fixative, depending on formulation and regulatory constraints.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	961.23
methanol	1085.67
isopropanol	796.01
water	0.11
ethyl acetate	266.58
n-propanol	590.81
acetone	1021.63
n-butanol	498.51
acetonitrile	195.36
DMF	1454.21
toluene	72.55
isobutanol	463.56
1,4-dioxane	456.15
methyl acetate	206.41
THF	1776.98
2-butanone	453.9
n-pentanol	399.15
sec-butanol	425.87
n-hexane	50.99
ethylene glycol	150.11
NMP	945.82
cyclohexane	31.74
DMSO	2775.91
n-butyl acetate	290.7
n-octanol	114.82
chloroform	342.13
n-propyl acetate	258.88
acetic acid	410.43
dichloromethane	304.76
cyclohexanone	750.78
propylene glycol	375.89
isopropyl acetate	257.41
DMAc	787.63
2-ethoxyethanol	498.32
isopentanol	480.79
n-heptane	13.29
ethyl formate	167.83
1,2-dichloroethane	337.85
n-hexanol	345.74
2-methoxyethanol	941.2
isobutyl acetate	208.35
tetrachloromethane	52.0
n-pentyl acetate	164.73
transcutol	1400.81
n-heptanol	119.89
ethylbenzene	65.69
MIBK	378.8
2-propoxyethanol	579.26
tert-butanol	937.02
MTBE	408.3
2-butoxyethanol	272.47
propionic acid	329.76
o-xylene	72.7
formic acid	138.37
diethyl ether	273.63
m-xylene	92.51
p-xylene	85.17
chlorobenzene	118.6
dimethyl carbonate	88.06
n-octane	5.74
formamide	212.15
cyclopentanone	1041.84
2-pentanone	493.43
anisole	171.28
cyclopentyl methyl ether	570.4
gamma-butyrolactone	865.79
1-methoxy-2-propanol	904.38
pyridine	283.57
3-pentanone	227.53
furfural	484.55
n-dodecane	5.01
diethylene glycol	405.1
diisopropyl ether	102.94
tert-amyl alcohol	520.04
acetylacetone	511.24
n-hexadecane	5.92
acetophenone	186.14
methyl propionate	238.05
isopentyl acetate	299.97
trichloroethylene	486.57
n-nonanol	99.26
cyclohexanol	419.02
benzyl alcohol	184.11
2-ethylhexanol	166.51
isooctanol	108.5
dipropyl ether	163.96
1,2-dichlorobenzene	128.5
ethyl lactate	143.36
propylene carbonate	365.28
n-methylformamide	460.56
2-pentanol	335.46
n-pentane	20.9
1-propoxy-2-propanol	439.79
1-methoxy-2-propyl acetate	334.04
2-(2-methoxypropoxy) propanol	295.17
mesitylene	72.63
ε-caprolactone	491.89
p-cymene	48.32
epichlorohydrin	800.63
1,1,1-trichloroethane	264.35
2-aminoethanol	434.83
morpholine-4-carbaldehyde	657.33
sulfolane	1354.14
2,2,4-trimethylpentane	16.44
2-methyltetrahydrofuran	809.67
n-hexyl acetate	251.68
isooctane	16.02
2-(2-butoxyethoxy)ethanol	425.77
sec-butyl acetate	182.93
tert-butyl acetate	371.52
decalin	26.83
glycerin	400.14
diglyme	670.49
acrylic acid	223.88
isopropyl myristate	89.28
n-butyric acid	528.81
acetyl acetate	136.09
di(2-ethylhexyl) phthalate	99.35
ethyl propionate	193.17
nitromethane	560.24
1,2-diethoxyethane	278.74
benzonitrile	173.25
trioctyl phosphate	74.9
1-bromopropane	199.56
gamma-valerolactone	988.37
n-decanol	71.85
triethyl phosphate	90.8
4-methyl-2-pentanol	205.93
propionitrile	194.03
vinylene carbonate	241.53
1,1,2-trichlorotrifluoroethane	548.3
DMS	150.69
cumene	59.28
2-octanol	83.6
2-hexanone	373.89
octyl acetate	109.93
limonene	83.63
1,2-dimethoxyethane	738.23
ethyl orthosilicate	89.56
tributyl phosphate	99.34
diacetone alcohol	598.1
N,N-dimethylaniline	138.97
acrylonitrile	208.74
aniline	171.47
1,3-propanediol	543.79
bromobenzene	108.86
dibromomethane	230.57
1,1,2,2-tetrachloroethane	507.48
2-methyl-cyclohexyl acetate	178.72
tetrabutyl urea	139.45
diisobutyl methanol	97.53
2-phenylethanol	180.98
styrene	75.59
dioctyl adipate	154.33
dimethyl sulfate	224.14
ethyl butyrate	172.18
methyl lactate	213.88
butyl lactate	187.2
diethyl carbonate	99.63
propanediol butyl ether	346.65
triethyl orthoformate	130.13
p-tert-butyltoluene	51.34
methyl 4-tert-butylbenzoate	200.71
morpholine	855.91
tert-butylamine	469.37
n-dodecanol	52.12
dimethoxymethane	551.69
ethylene carbonate	209.49
cyrene	273.99
2-ethoxyethyl acetate	212.94
2-ethylhexyl acetate	206.23
1,2,4-trichlorobenzene	161.4
4-methylpyridine	301.9
dibutyl ether	140.03
2,6-dimethyl-4-heptanol	97.53
DEF	455.89
dimethyl isosorbide	471.66
tetrachloroethylene	279.82
eugenol	200.6
triacetin	225.41
span 80	260.25
1,4-butanediol	213.57
1,1-dichloroethane	298.53
2-methyl-1-pentanol	322.17
methyl formate	224.64
2-methyl-1-butanol	384.16
n-decane	9.18
butyronitrile	280.01
3,7-dimethyl-1-octanol	136.13
1-chlorooctane	58.5
1-chlorotetradecane	20.32
n-nonane	8.83
undecane	6.54
tert-butylcyclohexane	28.6
cyclooctane	9.85
cyclopentanol	616.93
tetrahydropyran	632.99
tert-amyl methyl ether	279.82
2,5,8-trioxanonane	455.41
1-hexene	207.69
2-isopropoxyethanol	379.44
2,2,2-trifluoroethanol	103.63
methyl butyrate	299.16

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