Molecular formula
C14H15NO7

SMILES
C1=CC=C2C(=C1)C(=CN2)OC(=O)C3[C@H]([C@@H]([C@](O3)(CO)O)O)O

Fragrance
Odorless	64.8%
Sweet	42.11%
Vanilla	26.09%
Bitter	23.93%
Milky	21.69%
Savory	19.8%
Caramellic	19.02%
Balsamic	18.99%
Powdery	18.31%
Creamy	17.76%

 

Flavor
Bitter	77.02%
Odorless	44.67%
Bland	33.94%
Sweet-like	27.88%
Very mild	26.41%
Mild	20.19%
Cedarleaf	19.46%
Nitrile	19.02%
Orange flower	18.89%
Very slight	18.84%

 

Odor impact est.
Low

XLogP3-AA
0.0

pKa est.
4.94 (weak acid)

Molecular weight
309.27 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
1574°C

Flash point

• 300.85 ˚C est.

• Isotan B
• 1H-indol-3-yl (3S,4S,5R)-3,4,5-trihydroxy-5-(hydroxymethyl)oxolane-2-carboxylate
• CHEBI:6063
• Q27107013

Isotan B is an organic solvent and processing aid used across multiple industrial applications. Common uses include as a solvent and co-solvent in coatings and inks, as a plasticizer or additive in polymer formulations, as an intermediate in chemical synthesis, and in cleaning formulations or degreasing steps; it may also serve in surface pretreatment formulations. Its use is guided by formulation needs and local regulations.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	89.89
methanol	164.23
isopropanol	62.93
water	8.46
ethyl acetate	17.6
n-propanol	62.27
acetone	68.82
n-butanol	43.64
acetonitrile	14.7
DMF	419.82
toluene	0.41
isobutanol	23.83
1,4-dioxane	39.69
methyl acetate	25.41
THF	151.06
2-butanone	39.15
n-pentanol	16.73
sec-butanol	42.74
n-hexane	0.18
ethylene glycol	229.7
NMP	103.09
cyclohexane	0.37
DMSO	525.26
n-butyl acetate	2.49
n-octanol	5.45
chloroform	0.49
n-propyl acetate	5.41
acetic acid	163.88
dichloromethane	0.66
cyclohexanone	19.56
propylene glycol	168.55
isopropyl acetate	8.14
DMAc	347.46
2-ethoxyethanol	231.59
isopentanol	21.52
n-heptane	0.44
ethyl formate	16.93
1,2-dichloroethane	1.26
n-hexanol	7.02
2-methoxyethanol	661.81
isobutyl acetate	1.33
tetrachloromethane	0.17
n-pentyl acetate	3.87
transcutol	141.59
n-heptanol	7.18
ethylbenzene	0.29
MIBK	8.97
2-propoxyethanol	63.75
tert-butanol	40.79
MTBE	9.3
2-butoxyethanol	36.84
propionic acid	42.61
o-xylene	0.46
formic acid	392.51
diethyl ether	13.87
m-xylene	0.34
p-xylene	0.37
chlorobenzene	0.21
dimethyl carbonate	26.27
n-octane	0.32
formamide	580.2
cyclopentanone	53.51
2-pentanone	29.99
anisole	3.0
cyclopentyl methyl ether	15.15
gamma-butyrolactone	67.15
1-methoxy-2-propanol	317.06
pyridine	10.91
3-pentanone	14.85
furfural	33.5
n-dodecane	0.23
diethylene glycol	143.05
diisopropyl ether	1.95
tert-amyl alcohol	29.4
acetylacetone	37.44
n-hexadecane	0.25
acetophenone	3.99
methyl propionate	29.98
isopentyl acetate	2.17
trichloroethylene	1.62
n-nonanol	5.9
cyclohexanol	16.29
benzyl alcohol	6.84
2-ethylhexanol	2.43
isooctanol	4.49
dipropyl ether	4.99
1,2-dichlorobenzene	0.23
ethyl lactate	15.64
propylene carbonate	12.68
n-methylformamide	204.79
2-pentanol	21.64
n-pentane	0.32
1-propoxy-2-propanol	27.41
1-methoxy-2-propyl acetate	9.89
2-(2-methoxypropoxy) propanol	29.72
mesitylene	0.26
ε-caprolactone	21.05
p-cymene	0.33
epichlorohydrin	39.19
1,1,1-trichloroethane	0.35
2-aminoethanol	252.88
morpholine-4-carbaldehyde	158.27
sulfolane	84.63
2,2,4-trimethylpentane	0.14
2-methyltetrahydrofuran	34.04
n-hexyl acetate	4.85
isooctane	0.07
2-(2-butoxyethoxy)ethanol	55.71
sec-butyl acetate	2.77
tert-butyl acetate	7.81
decalin	0.1
glycerin	413.01
diglyme	91.55
acrylic acid	51.19
isopropyl myristate	2.04
n-butyric acid	39.34
acetyl acetate	5.5
di(2-ethylhexyl) phthalate	2.5
ethyl propionate	6.63
nitromethane	251.92
1,2-diethoxyethane	13.6
benzonitrile	1.68
trioctyl phosphate	2.45
1-bromopropane	0.73
gamma-valerolactone	112.5
n-decanol	4.52
triethyl phosphate	2.18
4-methyl-2-pentanol	6.83
propionitrile	8.13
vinylene carbonate	8.22
1,1,2-trichlorotrifluoroethane	52.56
DMS	5.25
cumene	0.23
2-octanol	4.31
2-hexanone	6.99
octyl acetate	3.57
limonene	0.67
1,2-dimethoxyethane	128.13
ethyl orthosilicate	2.19
tributyl phosphate	2.13
diacetone alcohol	49.94
N,N-dimethylaniline	2.39
acrylonitrile	13.36
aniline	3.56
1,3-propanediol	276.03
bromobenzene	0.12
dibromomethane	0.34
1,1,2,2-tetrachloroethane	1.84
2-methyl-cyclohexyl acetate	1.93
tetrabutyl urea	5.91
diisobutyl methanol	1.71
2-phenylethanol	3.85
styrene	0.31
dioctyl adipate	3.82
dimethyl sulfate	36.25
ethyl butyrate	3.13
methyl lactate	69.2
butyl lactate	8.17
diethyl carbonate	2.17
propanediol butyl ether	38.99
triethyl orthoformate	3.69
p-tert-butyltoluene	0.35
methyl 4-tert-butylbenzoate	7.2
morpholine	101.28
tert-butylamine	8.06
n-dodecanol	3.41
dimethoxymethane	198.03
ethylene carbonate	7.49
cyrene	34.69
2-ethoxyethyl acetate	10.04
2-ethylhexyl acetate	1.29
1,2,4-trichlorobenzene	0.45
4-methylpyridine	5.09
dibutyl ether	3.68
2,6-dimethyl-4-heptanol	1.71
DEF	51.04
dimethyl isosorbide	22.53
tetrachloroethylene	1.42
eugenol	11.86
triacetin	8.25
span 80	20.18
1,4-butanediol	80.93
1,1-dichloroethane	0.6
2-methyl-1-pentanol	8.77
methyl formate	105.12
2-methyl-1-butanol	21.58
n-decane	0.41
butyronitrile	7.24
3,7-dimethyl-1-octanol	3.24
1-chlorooctane	0.84
1-chlorotetradecane	0.45
n-nonane	0.37
undecane	0.3
tert-butylcyclohexane	0.07
cyclooctane	0.18
cyclopentanol	33.91
tetrahydropyran	22.48
tert-amyl methyl ether	9.62
2,5,8-trioxanonane	67.45
1-hexene	0.63
2-isopropoxyethanol	61.12
2,2,2-trifluoroethanol	53.7
methyl butyrate	10.31

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