Tetrasodium 4-[[1-hydroxy-6-[[[[5-hydroxy-6-[(2-methyl-4-sulphonatophenyl)azo]-7-sulphonato-2-naphthyl]amino]carbonyl]amino]-3-sulphonato-2-naphthyl]azo]benzoate
Basic information
- CAS
65072-27-7- Standard SMILES
Cc1cc(S(=O)(=O)[O-])ccc1N=Nc1c(S(=O)(=O)[O-])cc2cc(NC(=O)Nc3ccc4c(O)c(N=Nc5ccc(C(=O)[O-])cc5)c(S(=O)(=O)[O-])cc4c3)ccc2c1O.[Na+].[Na+].[Na+].[Na+]- InChIKey
ZWLSUPJXSLPRJM-UHFFFAOYSA-J- Molecular formula
- C35H22N6Na4O14S3
- Average molar mass
- 938.7 g/mol
- Monoisotopic mass
- 937.99469
Overview
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Names & identifiers
- Preferred name
- Tetrasodium 4-[[1-hydroxy-6-[[[[5-hydroxy-6-[(2-methyl-4-sulphonatophenyl)azo]-7-sulphonato-2-naphthyl]amino]carbonyl]amino]-3-sulphonato-2-naphthyl]azo]benzoate
- IUPAC
- tetrasodium;4-[[1-hydroxy-6-[[5-hydroxy-6-[(2-methyl-4-sulfonatophenyl)diazenyl]-7-sulfonatonaphthalen-2-yl]carbamoylamino]-3-sulfonatonaphthalen-2-yl]diazenyl]benzoate
- English name
- tetrasodium 4-[[1-hydroxy-6-[[[[5-hydroxy-6-[(2-methyl-4-sulphonatophenyl)azo]-7-sulphonato-2-naphthyl]amino]carbonyl]amino]-3-sulphonato-2-naphthyl]azo]benzoate
- Molecular formula
- C35H22N6Na4O14S3
- Molecular weight
- 938.73506
Names & synonyms
EINECS 265-365-2Tetrasodium 4-((1-hydroxy-6-((((5-hydroxy-6-((2-methyl-4-sulphonatophenyl)azo)-7-sulphonato-2-naphthyl)amino)carbonyl)amino)-3-sulphonato-2-naphthyl)azo)benzoateTetrasodium 4-[[1-hydroxy-6-[[[[5-hydroxy-6-[(2-methyl-4-sulphonatophenyl)azo]-7-sulphonato-2-naphthyl]amino]carbonyl]amino]-3-sulphonato-2-naphthyl]azo]benzoateRefChem:897488265-365-265072-27-74-1-hydroxy-6-5-hydroxy-6-(2-methyl-4-sulphonatophenyl)azo-7-sulphonato-2-naphthylaminocarbonylamino-3-sulph onato-2-naphthylazobenzoate (sodium salt)72245-49-9DTXSID701361204NS000554453-((4-Carboxyphenyl)azo)-4-hydroxy-7-((((5-hydroxy-6-((2-methyl-4-sulfophenyl)azo)-7-sulfo-2-naphthalenyl)amino)carbonyl)amino)-2-naphthalenesulfonic acid, sodium saltBenzoic acid, 4-(2-(1-hydroxy-6-((((5-hydroxy-6-(2-(2-methyl-4-sulfophenyl)diazenyl)-7-sulfo-2-naphthalenyl)amino)carbonyl)amino)-3-sulfo-2-naphthalenyl)diazenyl)-, sodium salt (1:?)
Properties
Computed structural properties
- Topological polar surface area
- 368 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 18
- Rotatable bonds
- 6
- Heavy atoms
- 62
- Formal charge
- 0
- Complexity
- 1,830
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (105 of 105) of all reports.
Not Classified
Aggregated GHS information provided per 105 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesNot Classified
Related reactions
0 records
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Compound notes
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