5-(2,4-Disulfophenyl)-2-(4-iodophenyl)-3-(4-nitrophenyl)-2H-tetrazolium inner salt sodium salt (1:1)

C₁₉H₁₁IN₅NaO₈S₂CAS 150849-52-8651.34 g/mol

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Aryl halide Nitro Sulfonic acid

Properties

Molecular formula: C₁₉H₁₁IN₅NaO₈S₂
Molar mass: 651.34 g/mol
Exact mass: 650.8991 Da
logP: 1.49Crippen estimate
Polar surface area: 189.3 Å²
H-bond donors / acceptors: 1 / 9
Rotatable bonds: 6

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number

150849-52-8

SMILES

[O-][N+](=O)c1ccc(-[n+]2nc(-c3ccc(S([O-])(=O)=O)cc3S([O-])(=O)=O)nn2-c2ccc(I)cc2)cc1.[Na+]

InChI

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

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Names and synonyms

3 names

2H-Tetrazolium, 5-(2,4-disulfophenyl)-2-(4-iodophenyl)-3-(4-nitrophenyl)-, inner salt, sodium salt (1:1)
2H-Tetrazolium, 5-(2,4-disulfophenyl)-2-(4-iodophenyl)-3-(4-nitrophenyl)-, inner salt, sodium salt
WST 1

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Similar compounds

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Tanimoto similarity of circular fingerprints over the whole catalogue.

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Elsewhere

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