2,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-[2-[4'-[2-(1-hydroxy-4-sulfo-2-naphthalenyl)diazenyl]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]diazenyl]-, lithium sodium salt (1:1:2)
Basic information
- CAS
75673-18-6- Standard SMILES
COc1cc(-c2ccc(N=Nc3c(S(=O)(=O)[O-])cc4cc(S(=O)(=O)[O-])cc(N)c4c3O)c(OC)c2)ccc1N=Nc1cc(S(=O)(=O)[O-])c2ccccc2c1O.[Li+].[Na+].[Na+]- InChIKey
SVNAUNGWHFDNRF-UHFFFAOYSA-K- Molecular formula
- C34H24LiN5Na2O13S3
- Average molar mass
- 859.7 g/mol
- Monoisotopic mass
- 859.04881636
Names & identifiers
- Preferred name
- 2,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-[2-[4'-[2-(1-hydroxy-4-sulfo-2-naphthalenyl)diazenyl]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]diazenyl]-, lithium sodium salt (1:1:2)
- IUPAC
- lithium;disodium;5-amino-4-hydroxy-3-[[4-[4-[(1-hydroxy-4-sulfonatonaphthalen-2-yl)diazenyl]-3-methoxyphenyl]-2-methoxyphenyl]diazenyl]naphthalene-2,7-disulfonate
- English name
- 2,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-[[4'- [(1-hydroxy-4-sulfo-2-naphthalenyl)azo]-3,3'-dimethoxy [1,1'-biphenyl]-4-yl]azo]-, monolithium disodium salt
- Molecular formula
- C34H27N5O13S3.Li.2Na
- Molecular weight
- 862.73
Names & synonyms
75673-18-6DTXSID808903652,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-((4'-((1-hydroxy-4-sulfo-2-naphthalenyl)azo)-3,3'-dimethoxy(1,1'-biphenyl)-4-yl)azo)-, monolithium disodium salt2,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-(2-(4'-(2-(1-hydroxy-4-sulfo-2-naphthalenyl)diazenyl)-3,3'-dimethoxy(1,1'-biphenyl)-4-yl)diazenyl)-, lithium sodium salt (1:1:2)5-Amino-4-hydroxy-3-((4'-((1-hydroxy-4-sulfo-2-naphthyl)azo)-3,3'-dimethoxy-4-biphenylyl)azo)-2,7-naphthalenedisulfonic acid, lithium sodium salt (1:1:2)2,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-[2-[4'-[2-(1-hydroxy-4-sulfo-2-naphthalenyl)diazenyl]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]diazenyl]-, lithium sodium salt (1:1:2)2,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-[[4'-[(1-hydroxy-4-sulfo-2-naphthalenyl)azo]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]azo]-, monolithium disodium saltRefChem:83552DTXCID701079352Lithium sodium 5-amino-4-hydroxy-3-({4'-[(1-hydroxy-4-sulfonatonaphthalen-2-yl)diazenyl]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl}diazenyl)naphthalene-2,7-disulfonate (1/2/1)
Properties
Computed structural properties
- Topological polar surface area
- 331 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 18
- Rotatable bonds
- 7
- Heavy atoms
- 58
- Formal charge
- 0
- Complexity
- 1,680
Physicochemical properties
- EPA Substance Registry System
- 2 · 2,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-[[4'-[(1-hydroxy-4-sulfo-2-naphthalenyl)azo]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]azo]-, monolithium disodium salt (75673-18-6)
- 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-[4'-[2-(1-hydroxy-4-sulfo-2-naphthalenyl)diazenyl]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]diazenyl]-, lithium sodium salt (1:1:2): INACTIVE
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