1,3-Naphthalenedisulfonic acid, 7-(2-(4-(2-(4-((4-aminobenzoyl)amino)-2-methylphenyl)diazenyl)-2-methylphenyl)diazenyl)-, sodium salt (1:2)
Basic information
- CAS
6949-09-3- Standard SMILES
Cc1cc(N=Nc2ccc(NC(=O)c3ccc(N)cc3)cc2C)ccc1N=Nc1ccc2cc(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c2c1.[Na+].[Na+]- InChIKey
BPNXJFXLNOABBB-UHFFFAOYSA-L- Molecular formula
- C31H24N6Na2O7S2
- Average molar mass
- 702.7 g/mol
- Monoisotopic mass
- 702.09432804
Names & identifiers
- Preferred name
- 1,3-Naphthalenedisulfonic acid, 7-(2-(4-(2-(4-((4-aminobenzoyl)amino)-2-methylphenyl)diazenyl)-2-methylphenyl)diazenyl)-, sodium salt (1:2)
- IUPAC
- disodium;7-[[4-[[4-[(4-aminobenzoyl)amino]-2-methylphenyl]diazenyl]-2-methylphenyl]diazenyl]naphthalene-1,3-disulfonate
Names & synonyms
NSC 658386949-09-3DTXSID108895251,3-Naphthalenedisulfonic acid, 7-((4-((4-((4-aminobenzoyl)amino)-2-methylphenyl)azo)-2-methylphenyl)azo)-, disodium salt1,3-Naphthalenedisulfonic acid, 7-(2-(4-(2-(4-((4-aminobenzoyl)amino)-2-methylphenyl)diazenyl)-2-methylphenyl)diazenyl)-, sodium salt (1:2)1,3-Naphthalenedisulfonic acid, 7-[2-[4-[2-[4-[(4-aminobenzoyl)amino]-2-methylphenyl]diazenyl]-2-methylphenyl]diazenyl]-, sodium salt (1:2)1,3-Naphthalenedisulfonic acid, 7-[[4-[[4-[(4-aminobenzoyl)amino]-2-methylphenyl]azo]-2-methylphenyl]azo]-, disodium saltRefChem:219349DTXCID201028778Disodium 7-[(4-{[4-(4-aminobenzamido)-2-methylphenyl]diazenyl}-2-methylphenyl)diazenyl]naphthalene-1,3-disulfonate
Database identifiers
- CAS
6949-09-3- PubChem CID
- 81383
- DTXSID
DTXSID10889525
Properties
Computed structural properties
- Topological polar surface area
- 236 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 6
- Heavy atoms
- 48
- Formal charge
- 0
- Complexity
- 1,300
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,3-Naphthalenedisulfonic acid, 7-[2-[4-[2-[4-[(4-aminobenzoyl)amino]-2-methylphenyl]diazenyl]-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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