Molecular formula
C18H13N4NaO6S

SMILES
C1=CC(=NN=C2C=CC(=O)C=C2)C=CC1=NC3=C(C=C(C=C3)N(O)O)S(=O)(=O)[O-].[Na+]

Fragrance
Odorless	55.87%
Roasted	39.12%
Nutty	29.35%
Cooked	27.96%
Meaty	27.48%
Savory	27.38%
Burnt	25.3%
Popcorn	22.74%
Caramellic	17.82%
Pungent	17.1%

 

Flavor
Bitter	83.91%
Odorless	31.41%
Nitrile	19.68%
Taco	19.36%
Bread crust	18.85%
Very strong	18.06%
Very mild	17.85%
Roasted peanuts	17.83%
Indole	17.82%
Bland	17.82%

 

Odor impact est.
Low

pKa est.
5.09 (weak acid)

Molecular weight
436.4 g/mol

Flash point

• 274.4 ˚C est.

Applications for the compound sodium;5-(dihydroxyamino)-2-[[4-[(4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinylidene]cyclohexa-2,5-dien-1-ylidene]amino]benzenesulfonate include serving as a water-soluble dye intermediate and colorant additive in textiles, printing inks, and coatings; it is commonly evaluated for use in polymer formulations to aid dye dispersion and water compatibility; it may be used as a colorant intermediate in cosmetic formulations, subject to regulatory compliance; and it can function as a water-soluble colorant additive in certain household cleaning products, subject to formulation limits and local regulations.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	0.9
methanol	1.21
isopropanol	0.53
water	0.01
ethyl acetate	1.68
n-propanol	0.86
acetone	3.17
n-butanol	0.47
acetonitrile	2.68
DMF	46.4
toluene	0.28
isobutanol	0.38
1,4-dioxane	9.73
methyl acetate	4.69
THF	18.42
2-butanone	6.5
n-pentanol	0.42
sec-butanol	1.03
n-hexane	0.01
ethylene glycol	1.1
NMP	38.67
cyclohexane	0.03
DMSO	23.12
n-butyl acetate	1.27
n-octanol	0.43
chloroform	0.71
n-propyl acetate	1.76
acetic acid	3.82
dichloromethane	1.03
cyclohexanone	5.75
propylene glycol	1.97
isopropyl acetate	0.94
DMAc	81.05
2-ethoxyethanol	8.0
isopentanol	0.31
n-heptane	0.03
ethyl formate	2.1
1,2-dichloroethane	0.75
n-hexanol	0.28
2-methoxyethanol	14.5
isobutyl acetate	0.59
tetrachloromethane	0.04
n-pentyl acetate	1.07
transcutol	19.85
n-heptanol	0.42
ethylbenzene	0.18
MIBK	0.67
2-propoxyethanol	7.64
tert-butanol	0.4
MTBE	0.63
2-butoxyethanol	4.13
propionic acid	3.39
o-xylene	0.24
formic acid	4.05
diethyl ether	0.77
m-xylene	0.13
p-xylene	0.28
chlorobenzene	0.33
dimethyl carbonate	4.01
n-octane	0.02
formamide	12.58
cyclopentanone	12.95
2-pentanone	1.63
anisole	2.24
cyclopentyl methyl ether	1.65
gamma-butyrolactone	18.07
1-methoxy-2-propanol	9.61
pyridine	9.11
3-pentanone	2.16
furfural	18.16
n-dodecane	0.02
diethylene glycol	6.11
diisopropyl ether	0.11
tert-amyl alcohol	0.82
acetylacetone	3.77
n-hexadecane	0.02
acetophenone	3.11
methyl propionate	3.79
isopentyl acetate	0.96
trichloroethylene	2.69
n-nonanol	0.54
cyclohexanol	0.68
benzyl alcohol	1.99
2-ethylhexanol	0.27
isooctanol	0.28
dipropyl ether	0.98
1,2-dichlorobenzene	0.37
ethyl lactate	3.06
propylene carbonate	4.07
n-methylformamide	12.59
2-pentanol	0.32
n-pentane	0.01
1-propoxy-2-propanol	5.47
1-methoxy-2-propyl acetate	4.44
2-(2-methoxypropoxy) propanol	6.82
mesitylene	0.08
ε-caprolactone	6.43
p-cymene	0.14
epichlorohydrin	12.61
1,1,1-trichloroethane	0.19
2-aminoethanol	2.01
morpholine-4-carbaldehyde	44.67
sulfolane	26.05
2,2,4-trimethylpentane	0.01
2-methyltetrahydrofuran	4.01
n-hexyl acetate	1.28
isooctane	0.0
2-(2-butoxyethoxy)ethanol	7.63
sec-butyl acetate	0.91
tert-butyl acetate	0.89
decalin	0.02
glycerin	6.24
diglyme	17.94
acrylic acid	4.87
isopropyl myristate	0.58
n-butyric acid	1.65
acetyl acetate	1.27
di(2-ethylhexyl) phthalate	0.96
ethyl propionate	1.86
nitromethane	18.9
1,2-diethoxyethane	3.62
benzonitrile	2.01
trioctyl phosphate	0.54
1-bromopropane	0.25
gamma-valerolactone	35.8
n-decanol	0.4
triethyl phosphate	1.37
4-methyl-2-pentanol	0.14
propionitrile	1.87
vinylene carbonate	4.8
1,1,2-trichlorotrifluoroethane	14.14
DMS	3.1
cumene	0.1
2-octanol	0.28
2-hexanone	1.73
octyl acetate	0.93
limonene	0.21
1,2-dimethoxyethane	18.49
ethyl orthosilicate	1.1
tributyl phosphate	0.71
diacetone alcohol	2.71
N,N-dimethylaniline	1.52
acrylonitrile	4.69
aniline	1.3
1,3-propanediol	2.12
bromobenzene	0.22
dibromomethane	0.33
1,1,2,2-tetrachloroethane	2.01
2-methyl-cyclohexyl acetate	1.4
tetrabutyl urea	1.77
diisobutyl methanol	0.16
2-phenylethanol	1.41
styrene	0.29
dioctyl adipate	1.69
dimethyl sulfate	8.91
ethyl butyrate	1.76
methyl lactate	6.51
butyl lactate	2.21
diethyl carbonate	1.5
propanediol butyl ether	3.93
triethyl orthoformate	2.1
p-tert-butyltoluene	0.12
methyl 4-tert-butylbenzoate	3.21
morpholine	16.07
tert-butylamine	0.14
n-dodecanol	0.29
dimethoxymethane	12.21
ethylene carbonate	2.84
cyrene	10.0
2-ethoxyethyl acetate	3.41
2-ethylhexyl acetate	0.83
1,2,4-trichlorobenzene	0.86
4-methylpyridine	3.96
dibutyl ether	0.79
2,6-dimethyl-4-heptanol	0.16
DEF	7.29
dimethyl isosorbide	11.38
tetrachloroethylene	0.91
eugenol	3.94
triacetin	4.2
span 80	3.92
1,4-butanediol	0.95
1,1-dichloroethane	0.29
2-methyl-1-pentanol	0.36
methyl formate	8.25
2-methyl-1-butanol	0.48
n-decane	0.04
butyronitrile	1.02
3,7-dimethyl-1-octanol	0.34
1-chlorooctane	0.15
1-chlorotetradecane	0.07
n-nonane	0.03
undecane	0.03
tert-butylcyclohexane	0.01
cyclooctane	0.01
cyclopentanol	1.37
tetrahydropyran	2.96
tert-amyl methyl ether	0.83
2,5,8-trioxanonane	12.83
1-hexene	0.09
2-isopropoxyethanol	3.88
2,2,2-trifluoroethanol	1.9
methyl butyrate	2.59

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