Molecular formula
C36H60O30

SMILES
C(C1[C@@H]2C(C([C@H](O1)O[C@@H]3C(O[C@@H](C(C3O)O)O[C@@H]4C(O[C@@H](C(C4O)O)O[C@@H]5C(O[C@@H](C(C5O)O)O[C@@H]6C(O[C@@H](C(C6O)O)O[C@@H]7C(O[C@H](O2)C(C7O)O)CO)CO)CO)CO)CO)O)O)O

Fragrance
Odorless	80.41%
Sweet	26.9%
Alcoholic	21.3%
Caramellic	17.16%
Clean	15.46%
Savory	15.25%
Cooling	14.86%
Milky	14.1%
Fishy	13.96%
Bitter	13.34%

 

Flavor
Sweet	75.26%
Odorless	48.39%
Bitter	45.59%
Sweet-like	31.05%
Fatty	27.48%
Cauliflower	22.69%
Very slight	21.41%
Alkaline	20.85%
Soup	20.39%
Naphthalic	20.1%

 

Odor impact est.
Low

XLogP3-AA
-12.9

pKa est.
65.55 (strong base)

Molecular weight
972.8 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Fast

Boiling point est.
4279°C

Flash point

• 581.6 ˚C est.

• MFCD00078207
• CHEMBL2373320
• SCHEMBL12459493
• (1S,3R,6S,8R,11S,13R,16S,18R,21S,23R,26S,28R)-5,10,15,20,25,30-Hexakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29-dodecaoxaheptacyclo[26.2.2.23,6.28,11.213,16.218,21.223,26]dotetracontane-31,32,33,34,35,36,37,38,39,40,41,42-dodecol

CID 24796 is an organic compound that may be used as an intermediate in organic synthesis, including pharmaceuticals, agrochemicals, and other specialty chemicals. It may serve as a solvent or processing aid in coatings, inks, adhesives, and cleaning formulations. It can function as a stabilizer or a chelating agent in polymer formulations. It may be considered for fragrance-related applications as an odorant or component in perfumery, and could have potential in cosmetics/personal care formulations under appropriate regulatory constraints.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	8.44
methanol	26.75
isopropanol	2.52
water	11.81
ethyl acetate	2.42
n-propanol	3.82
acetone	3.19
n-butanol	2.27
acetonitrile	1.52
DMF	45.65
toluene	0.83
isobutanol	1.3
1,4-dioxane	7.48
methyl acetate	2.48
THF	14.26
2-butanone	2.71
n-pentanol	1.26
sec-butanol	1.6
n-hexane	0.08
ethylene glycol	16.54
NMP	60.39
cyclohexane	0.21
DMSO	61.94
n-butyl acetate	1.38
n-octanol	1.34
chloroform	1.39
n-propyl acetate	1.03
acetic acid	27.47
dichloromethane	1.85
cyclohexanone	4.87
propylene glycol	11.72
isopropyl acetate	1.27
DMAc	34.82
2-ethoxyethanol	12.06
isopentanol	0.91
n-heptane	0.22
ethyl formate	4.05
1,2-dichloroethane	1.17
n-hexanol	1.13
2-methoxyethanol	31.23
isobutyl acetate	0.4
tetrachloromethane	0.44
n-pentyl acetate	2.18
transcutol	18.79
n-heptanol	1.75
ethylbenzene	0.26
MIBK	0.78
2-propoxyethanol	10.62
tert-butanol	1.03
MTBE	0.58
2-butoxyethanol	9.44
propionic acid	7.09
o-xylene	0.59
formic acid	84.15
diethyl ether	1.53
m-xylene	0.48
p-xylene	0.25
chlorobenzene	0.43
dimethyl carbonate	6.28
n-octane	0.13
formamide	68.41
cyclopentanone	9.3
2-pentanone	2.33
anisole	0.7
cyclopentyl methyl ether	3.87
gamma-butyrolactone	16.96
1-methoxy-2-propanol	17.55
pyridine	5.8
3-pentanone	1.85
furfural	18.22
n-dodecane	0.07
diethylene glycol	17.95
diisopropyl ether	0.27
tert-amyl alcohol	1.0
acetylacetone	3.89
n-hexadecane	0.08
acetophenone	1.44
methyl propionate	4.38
isopentyl acetate	0.81
trichloroethylene	2.29
n-nonanol	1.3
cyclohexanol	1.96
benzyl alcohol	1.85
2-ethylhexanol	0.57
isooctanol	0.88
dipropyl ether	1.37
1,2-dichlorobenzene	0.4
ethyl lactate	2.78
propylene carbonate	6.26
n-methylformamide	26.59
2-pentanol	1.04
n-pentane	0.13
1-propoxy-2-propanol	6.51
1-methoxy-2-propyl acetate	4.48
2-(2-methoxypropoxy) propanol	4.3
mesitylene	0.25
ε-caprolactone	6.93
p-cymene	0.32
epichlorohydrin	7.96
1,1,1-trichloroethane	0.39
2-aminoethanol	14.99
morpholine-4-carbaldehyde	48.82
sulfolane	38.4
2,2,4-trimethylpentane	0.04
2-methyltetrahydrofuran	3.94
n-hexyl acetate	1.8
isooctane	0.02
2-(2-butoxyethoxy)ethanol	8.3
sec-butyl acetate	0.55
tert-butyl acetate	1.0
decalin	0.06
glycerin	33.66
diglyme	14.81
acrylic acid	13.67
isopropyl myristate	0.52
n-butyric acid	5.9
acetyl acetate	2.05
di(2-ethylhexyl) phthalate	0.89
ethyl propionate	1.14
nitromethane	23.94
1,2-diethoxyethane	3.14
benzonitrile	0.98
trioctyl phosphate	0.87
1-bromopropane	0.56
gamma-valerolactone	28.96
n-decanol	0.84
triethyl phosphate	1.03
4-methyl-2-pentanol	0.38
propionitrile	1.06
vinylene carbonate	7.25
1,1,2-trichlorotrifluoroethane	21.28
DMS	2.47
cumene	0.16
2-octanol	0.9
2-hexanone	0.86
octyl acetate	1.08
limonene	0.49
1,2-dimethoxyethane	8.11
ethyl orthosilicate	0.9
tributyl phosphate	0.73
diacetone alcohol	3.33
N,N-dimethylaniline	0.8
acrylonitrile	2.51
aniline	2.03
1,3-propanediol	12.48
bromobenzene	0.31
dibromomethane	1.0
1,1,2,2-tetrachloroethane	1.79
2-methyl-cyclohexyl acetate	0.81
tetrabutyl urea	1.44
diisobutyl methanol	0.31
2-phenylethanol	1.49
styrene	0.29
dioctyl adipate	1.17
dimethyl sulfate	16.34
ethyl butyrate	1.22
methyl lactate	12.43
butyl lactate	3.8
diethyl carbonate	0.85
propanediol butyl ether	9.49
triethyl orthoformate	1.45
p-tert-butyltoluene	0.32
methyl 4-tert-butylbenzoate	2.83
morpholine	13.19
tert-butylamine	0.4
n-dodecanol	0.53
dimethoxymethane	17.16
ethylene carbonate	4.57
cyrene	8.74
2-ethoxyethyl acetate	4.86
2-ethylhexyl acetate	0.72
1,2,4-trichlorobenzene	0.62
4-methylpyridine	2.87
dibutyl ether	0.82
2,6-dimethyl-4-heptanol	0.31
DEF	7.29
dimethyl isosorbide	8.41
tetrachloroethylene	1.85
eugenol	3.18
triacetin	3.89
span 80	5.42
1,4-butanediol	4.64
1,1-dichloroethane	0.55
2-methyl-1-pentanol	0.57
methyl formate	18.62
2-methyl-1-butanol	1.11
n-decane	0.15
butyronitrile	0.99
3,7-dimethyl-1-octanol	0.53
1-chlorooctane	0.38
1-chlorotetradecane	0.13
n-nonane	0.14
undecane	0.1
tert-butylcyclohexane	0.03
cyclooctane	0.14
cyclopentanol	3.53
tetrahydropyran	3.25
tert-amyl methyl ether	0.83
2,5,8-trioxanonane	9.58
1-hexene	0.2
2-isopropoxyethanol	4.12
2,2,2-trifluoroethanol	18.05
methyl butyrate	1.55

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