Basic information
- CAS
67939-43-9- Standard SMILES
COc1cc(N=Nc2cc(S(=O)(=O)[O-])cc3cc(S(=O)(=O)[O-])cc(OS(=O)(=O)c4ccccc4)c23)c(C)cc1N=Nc1c(S(=O)(=O)[O-])cc2cc(S(=O)(=O)[O-])cc(N)c2c1O.[Na+].[Na+].[Na+].[Na+]- InChIKey
AWEUDCQIDNNFEO-UHFFFAOYSA-J- Molecular formula
- C34H23N5Na4O17S5
- Average molar mass
- 1,025.9 g/mol
- Monoisotopic mass
- 1,024.9283273
Names & identifiers
- Preferred name
- 2,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-[2-[2-methoxy-5-methyl-4-[2-[8-[(phenylsulfonyl)oxy]-3,6-disulfo-1-naphthalenyl]diazenyl]phenyl]diazenyl]-, sodium salt (1:4)
- IUPAC
- tetrasodium;5-amino-3-[[4-[[8-(benzenesulfonyloxy)-3,6-disulfonatonaphthalen-1-yl]diazenyl]-2-methoxy-5-methylphenyl]diazenyl]-4-hydroxynaphthalene-2,7-disulfonate
- English name
- tetrasodium 4-amino-5-hydroxy-6-[[2-methoxy-5-methyl-4-[[8-[(phenylsulphonyl)oxy]-3,6-disulphonato-1-naphthyl]azo]phenyl]azo]naphthalene-2,7-disulphonate
- Molecular formula
- C34H23N5Na4O17S5
- Molecular weight
- 1025.8538
Names & synonyms
67939-43-9EINECS 267-837-3DTXSID008898972,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-6-((2-methoxy-5-methyl-4-((8-((phenylsulfonyl)oxy)-3,6-disulfo-1-naphthalenyl)azo)phenyl)azo)-, tetrasodium salt2,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-(2-(2-methoxy-5-methyl-4-(2-(8-((phenylsulfonyl)oxy)-3,6-disulfo-1-naphthalenyl)diazenyl)phenyl)diazenyl)-, sodium salt (1:4)2,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-6-[[2-methoxy-5-methyl-4-[[8-[(phenylsulfonyl)oxy]-3,6-disulfo-1-naphthalenyl]azo]phenyl]azo]-, tetrasodium salt2,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-[2-[2-methoxy-5-methyl-4-[2-[8-[(phenylsulfonyl)oxy]-3,6-disulfo-1-naphthalenyl]diazenyl]phenyl]diazenyl]-, sodium salt (1:4)RefChem:83550DTXCID6010314184-amino-5-hydroxy-6-2-methoxy-5-methyl-4-8-(phenylsulphonyl)oxy-3,6-Disulphonato-1-naphthylazophenylazonaphtha lene-2,7-disulphonate (sodium salt)OCJWWQYHRHJEAG-GNOZSJPYSA-JNS00087841
Show more names
AKHVCOKCBXCTBG-TTWRLMKCSA-Ntetrasodium 4-amino-5-hydroxy-6-[[2-methoxy-5-methyl-4-[[8-[(phenylsulphonyl)oxy]-3,6-disulphonato-1-naphthyl]azo]phenyl]azo]naphthalene-2,7-disulphonate4-Amino-5-hydroxy-6-[[2-methoxy-5-methyl-4-[[8-[(phenylsulfonyl)oxy]-3,6-disulfo-1-naphthalenyl]azo]phenyl]azo]-2,7-naphthalenedisulfonic acid tetrasodium salt
Tetrasodium 4-amino-5-hydroxy-6-((2-methoxy-5-methyl-4-((8-((phenylsulphonyl)oxy)-3,6-disulphonato-1-naphthyl)azo)phenyl)azo)naphthalene-2,7-disulphonateTetrasodium 5-amino-3-{[4-({8-[(benzenesulfonyl)oxy]-3,6-disulfonatonaphthalen-1-yl}diazenyl)-2-methoxy-5-methylphenyl]diazenyl}-4-hydroxynaphthalene-2,7-disulfonate
Database identifiers
- CAS
67939-43-9- PubChem CID
- 172017
- DTXSID
DTXSID00889897- EC Number
- 267-837-3
Properties
Computed structural properties
- Topological polar surface area
- 419 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 22
- Rotatable bonds
- 8
- Heavy atoms
- 65
- Formal charge
- 0
- Complexity
- 2,130
Physicochemical properties
- EPA Substance Registry System
- 2 · 2,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-6-[[2-methoxy-5-methyl-4-[[8-[(phenylsulfonyl)oxy]-3,6-disulfo-1-naphthalenyl]azo]phenyl]azo]-, tetrasodium salt (67939-43-9)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-[2-[2-methoxy-5-methyl-4-[2-[8-[(phenylsulfonyl)oxy]-3,6-disulfo-1-naphthalenyl]diazenyl]phenyl]diazenyl]-, sodium salt (1:4): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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