Tetrasodium 4,4'-((3,3'-dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(azo))bis(3-hydroxynaphthalene-2,7-disulphonate)
Basic information
- CAS
65151-33-9- Standard SMILES
COc1cc(-c2ccc(N=Nc3c(O)c(S(=O)(=O)[O-])cc4ccc(S(=O)(=O)[O-])cc34)c(OC)c2)ccc1N=Nc1c(O)c(S(=O)(=O)[O-])cc2cc(S(=O)(=O)[O-])ccc12.[Na+].[Na+].[Na+].[Na+]- InChIKey
GVDFRGHTRNVCIX-UHFFFAOYSA-J- Molecular formula
- C34H22N4Na4O16S4
- Average molar mass
- 962.8 g/mol
- Monoisotopic mass
- 961.9504424
Names & identifiers
- Preferred name
- Tetrasodium 4,4'-((3,3'-dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(azo))bis(3-hydroxynaphthalene-2,7-disulphonate)
- IUPAC
- tetrasodium;3-hydroxy-4-[[4-[4-[(2-hydroxy-3,6-disulfonatonaphthalen-1-yl)diazenyl]-3-methoxyphenyl]-2-methoxyphenyl]diazenyl]naphthalene-2,6-disulfonate
Names & synonyms
Tetrasodium 4,4'-((3,3'-dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(azo))bis(3-hydroxynaphthalene-2,7-disulphonate)
Database identifiers
- CAS
65151-33-9- PubChem CID
- 103265
Properties
Computed structural properties
- Topological polar surface area
- 371 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 20
- Rotatable bonds
- 7
- Heavy atoms
- 62
- Formal charge
- 0
- Complexity
- 1,900
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Compound notes
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