1,3-Naphthalenedisulfonic acid, 7-(2-(4-((4-aminobenzoyl)amino)-2-methylphenyl)diazenyl)-, sodium salt (1:2)
Basic information
- CAS
6330-82-1- Standard SMILES
Cc1cc(NC(=O)c2ccc(N)cc2)ccc1N=Nc1ccc2cc(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c2c1.[Na+].[Na+]- InChIKey
NRADSJPKTBQUOF-UHFFFAOYSA-L- Molecular formula
- C24H18N4Na2O7S2
- Average molar mass
- 584.5 g/mol
- Monoisotopic mass
- 584.04122984
Names & identifiers
- Preferred name
- 1,3-Naphthalenedisulfonic acid, 7-(2-(4-((4-aminobenzoyl)amino)-2-methylphenyl)diazenyl)-, sodium salt (1:2)
- IUPAC
- disodium;7-[[4-[(4-aminobenzoyl)amino]-2-methylphenyl]diazenyl]naphthalene-1,3-disulfonate
Names & synonyms
6330-82-1NSC 456001,3-Naphthalenedisulfonic acid, 7-((4-((4-aminobenzoyl)amino)-2-methylphenyl)azo)-, disodium saltDTXSID608895101,3-Naphthalenedisulfonic acid, 7-(2-(4-((4-aminobenzoyl)amino)-2-methylphenyl)diazenyl)-, sodium salt (1:2)1,3-Naphthalenedisulfonic acid, 7-[[4-[(4-aminobenzoyl)amino]-2-methylphenyl]azo]-, disodium salt1,3-Naphthalenedisulfonic acid, 7-[2-[4-[(4-aminobenzoyl)amino]-2-methylphenyl]diazenyl]-, sodium salt (1:2)RefChem:72868DTXCID101028763SCHEMBL7794856Disodium 7-{[4-(4-aminobenzamido)-2-methylphenyl]diazenyl}naphthalene-1,3-disulfonate
Database identifiers
- CAS
6330-82-1- PubChem CID
- 72693
- DTXSID
DTXSID60889510
Properties
Computed structural properties
- Topological polar surface area
- 211 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 4
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 1,020
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,3-Naphthalenedisulfonic acid, 7-[2-[4-[(4-aminobenzoyl)amino]-2-methylphenyl]diazenyl]-, sodium salt (1:2): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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