Basic information
- CAS
65152-15-0- Standard SMILES
Cc1cc(-c2ccc(N=Nc3cc(S(=O)(=O)[O-])c4cc(S(=O)(=O)[O-])ccc4c3N)c(C)c2)ccc1N=Nc1cc(S(=O)(=O)[O-])c2ccccc2c1N.[Na+].[Na+].[Na+]- InChIKey
KABQNSURLZIYJF-UHFFFAOYSA-K- Molecular formula
- C34H25N6Na3O9S3
- Average molar mass
- 826.8 g/mol
- Monoisotopic mass
- 826.05382276
Names & identifiers
- Preferred name
- 1,7-Naphthalenedisulfonic acid, 4-amino-3-(2-(4'-(2-(1-amino-4-sulfo-2-naphthalenyl)diazenyl)-3,3'-dimethyl(1,1'-biphenyl)-4-yl)diazenyl)-, sodium salt (1:3)
- IUPAC
- trisodium;4-amino-3-[[4-[4-[(1-amino-4-sulfonatonaphthalen-2-yl)diazenyl]-3-methylphenyl]-2-methylphenyl]diazenyl]naphthalene-1,7-disulfonate
Names & synonyms
65152-15-01,7-Naphthalenedisulfonic acid, 4-amino-3-((4'-((1-amino-4-sulfo-2-naphthalenyl)azo)-3,3'-dimethyl(1,1'-biphenyl)-4-yl)azo)-, trisodium salt1,7-Naphthalenedisulfonic acid, 4-amino-3-((4'-((1-amino-4-sulfo-2-naphthyl)azo)-3,3'-dimethyl-4-biphenylyl)azo)-, trisodium salt1,7-Naphthalenedisulfonic acid, 4-amino-3-(2-(4'-(2-(1-amino-4-sulfo-2-naphthalenyl)diazenyl)-3,3'-dimethyl(1,1'-biphenyl)-4-yl)diazenyl)-, sodium salt (1:3)1,7-Naphthalenedisulfonic acid, 4-amino-3-[[4'-[(1-amino-4-sulfo-2-naphthalenyl)azo]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]azo]-, trisodium salt1,7-Naphthalenedisulfonic acid, 4-amino-3-[2-[4'-[2-(1-amino-4-sulfo-2-naphthalenyl)diazenyl]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]diazenyl]-, sodium salt (1:3)RefChem:417831trisodium 4-amino-3-[(e)-{4'-[(e)-(1-amino-4-sulfonatonaphthalen-2-yl)diazenyl]-3,3'-dimethylbiphenyl-4-yl}diazenyl]naphthalene-1,7-disulfonate67617-63-4DTXSID2070265DTXSID20275995KABQNSURLZIYJF-UHFFFAOYSA-K
Show more names
Trisodium 4-amino-3-({4'-[(1-amino-4-sulfonatonaphthalen-2-yl)diazenyl]-3,3'-dimethyl[1,1'-biphenyl]-4-yl}diazenyl)naphthalene-1,7-disulfonateTrisodium 4-amino-3-[(E)-{4'-[(E)-(1-amino-4-sulfonatonaphthalen-2-yl)diazenyl]-3,3'-dimethyl[1,1'-biphenyl]-4-yl}diazenyl]naphthalene-1,7-disulfonate
Properties
Computed structural properties
- Topological polar surface area
- 298 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 15
- Rotatable bonds
- 5
- Heavy atoms
- 55
- Formal charge
- 0
- Complexity
- 1,610
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,7-Naphthalenedisulfonic acid, 4-amino-3-[2-[4'-[2-(1-amino-4-sulfo-2-naphthalenyl)diazenyl]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]diazenyl]-, sodium salt (1:3): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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