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Disodium 4-amino-3-hydroxy-2,7-naphthalenedisulfonate

HCID 16176
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Basic information

CAS
42579-07-7
Standard SMILES
Nc1c(O)c(S(=O)(=O)[O-])cc2cc(S(=O)(=O)[O-])ccc12.[Na+].[Na+]
InChIKey
WWKQYOVTXCEQDS-UHFFFAOYSA-L
Molecular formula
C10H7NNa2O7S2
Average molar mass
363.3 g/mol
Monoisotopic mass
362.94593247

Names & identifiers

Preferred name
Disodium 4-amino-3-hydroxy-2,7-naphthalenedisulfonate
IUPAC
disodium;4-amino-3-hydroxynaphthalene-2,7-disulfonate

Names & synonyms

42579-07-7Disodium 4-amino-3-hydroxy-2,7-naphthalenedisulfonate1-Amino-2-naphthol-3,6-disulfonic acid disodium saltA6I8ZBA7302,7-NAPHTHALENEDISULFONIC ACID, 4-AMINO-3-HYDROXY-, DISODIUM SALTSodium 4-amino-3-hydroxynaphthalene-2,7-disulfonatedisodium 1-amino-2-naphthol-3,6-disulfonateSCHEMBL8100903WWKQYOVTXCEQDS-UHFFFAOYSA-LQ272736954-amino-3-hydroxynaphthalene-2,7-disulfonic acid disodium salt2,7-NAPHTHALENEDISULFONIC ACID, 4-AMINO-3-HYDROXY-, SODIUM SALT (1:2)

Database identifiers

CAS
42579-07-7
PubChem CID
16176
UNII
A6I8ZBA730

Properties

Computed structural properties

Topological polar surface area
177 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
0
Heavy atoms
22
Formal charge
0
Complexity
535

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