Azomethine-H monosodium

C₁₇H₁₂NNaO₈S₂CAS 5941-07-1445.39 g/mol

Open in Covalent MOL file

Imine Phenol Sulfonic acid

Properties

Molecular formula: C₁₇H₁₂NNaO₈S₂
Molar mass: 445.39 g/mol
Exact mass: 444.9902 Da
logP: 2.11Crippen estimate
Polar surface area: 161.6 Å²
H-bond donors / acceptors: 4 / 7
Rotatable bonds: 4

Hazards

Warning

H315 Causes skin irritation92.9% of notifiers
H319 Causes serious eye irritation95.2% of notifiers
H335 May cause respiratory irritation90.5% of notifiers

Aggregated from 42 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

5941-07-1

SMILES

[O-]S(=O)(=O)c1cc(O)c2c(c1)cc(S(=O)(=O)O)cc2N=Cc1ccccc1O.[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.

Weigh it out

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

Names and synonyms

3 names

2,7-Naphthalenedisulfonic acid, 4-hydroxy-5-[[(2-hydroxyphenyl)methylene]amino]-, sodium salt (1:1)
2,7-Naphthalenedisulfonic acid, 4-hydroxy-5-(salicylideneamino)-, monosodium salt
2,7-Naphthalenedisulfonic acid, 4-hydroxy-5-[[(2-hydroxyphenyl)methylene]amino]-, monosodium salt

Work with Azomethine-H monosodium

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Azomethine-H sodium206752-32-1Hydrate Azomethine H32266-60-7Free acid

Similar compounds

4-Amino-5-hydroxy-2,7-naphthalenedisulfonic acid monosodium salt5460-09-356 % similar Chromotropic acid disodium salt dihydrate5808-22-048 % similar Chromotropic acid148-25-445 % similar Acid chrome blue K3270-25-544 % similar 4-Hydroxy-2,7-naphthalenedisulfonic acid disodium salt20349-39-742 % similar 8-Hydroxy-1,6-naphthalenedisulfonic acid117-43-141 % similar ANTS5398-34-541 % similar N,N'-Bis(salicylidene)-1,2-phenylenediamine3946-91-640 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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