Sodium diphenylamine-4-sulfonate

C₁₂H₁₀NNaO₃SCAS 6152-67-6271.27 g/mol

Open in Covalent MOL file

Secondary amine Sulfonic acid

Properties

Molecular formula: C₁₂H₁₀NNaO₃S
Molar mass: 271.27 g/mol
Exact mass: 271.0279 Da
logP: 2.30Crippen estimate
Polar surface area: 66.4 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 3

Identifiers

CAS number

6152-67-6

SMILES

[O-]S(=O)(=O)c1ccc(Nc2ccccc2)cc1.[Na+]

InChIKey

VMVSDVIYIMNZBS-UHFFFAOYSA-N

InChI

InChI=1S/C12H11NO3S.Na/c14-17(15,16)12-8-6-11(7-9-12)13-10-4-2-1-3-5-10;/h1-9,13H,(H,14,15,16);

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names

Benzenesulfonic acid, 4-(phenylamino)-, sodium salt (1:1)
Sulfanilic acid, N-phenyl-, sodium salt
Benzenesulfonic acid, 4-(phenylamino)-, monosodium salt
N-Phenylsulfanilic acid sodium salt
SDPAS

Work with Sodium diphenylamine-4-sulfonate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Barium diphenylamine-4-sulfonate6211-24-183 % similar Acid orange 5554-73-482 % similar Sodium benzenesulfonate515-42-468 % similar Metanil yellow587-98-464 % similar Sodium 4-methylbenzenesulfonate12068-03-052 % similar Sodium P-aminobenzenesulfonate515-74-252 % similar Sodium P-toluenesulfonate657-84-152 % similar Sodium 4-hydroxybenzenesulfonate825-90-152 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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