Basic information
- CAS
73612-32-5- Standard SMILES
O=S(=O)([O-])c1ccc2cc(N=Nc3c(O)ccc4ccccc34)ccc2c1.O=S(=O)([O-])c1ccc2cc(N=Nc3c(O)ccc4ccccc34)ccc2c1.[Ca+2]- InChIKey
KEHBBQHDKMKZLG-UHFFFAOYSA-L- Molecular formula
- C40H26CaN4O8S2
- Average molar mass
- 794.9 g/mol
- Monoisotopic mass
- 794.081797
Names & identifiers
- Preferred name
- 2-Naphthalenesulfonic acid, 6-(2-(2-hydroxy-1-naphthalenyl)diazenyl)-, calcium salt (2:1)
- IUPAC
- calcium bis(6-[(2-hydroxynaphthalen-1-yl)diazenyl]naphthalene-2-sulfonate)
Names & synonyms
73612-32-56-((2-Hydroxy-1-naphthalenyl)azo)-2-naphthalenesulfonic acid, calcium salt (2:1)DTXSID808910792-Naphthalenesulfonic acid, 6-((2-hydroxy-1-naphthalenyl)azo)-, calcium salt (2:1)2-Naphthalenesulfonic acid, 6-(2-(2-hydroxy-1-naphthalenyl)diazenyl)-, calcium salt (2:1)2-Naphthalenesulfonic acid, 6-[(2-hydroxy-1-naphthalenyl)azo]-, calcium salt (2:1)2-Naphthalenesulfonic acid, 6-[2-(2-hydroxy-1-naphthalenyl)diazenyl]-, calcium salt (2:1)RefChem:88541DTXCID601030327TYGBTRSMPXWQJY-SPAPECPESA-LCalcium bis{6-[(2-hydroxynaphthalen-1-yl)diazenyl]naphthalene-2-sulfonate}
Database identifiers
- CAS
73612-32-5- PubChem CID
- 175507
- DTXSID
DTXSID80891079
Properties
Computed structural properties
- Topological polar surface area
- 221 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 4
- Heavy atoms
- 55
- Formal charge
- 0
- Complexity
- 634
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Naphthalenesulfonic acid, 6-[2-(2-hydroxy-1-naphthalenyl)diazenyl]-, calcium salt (2:1): ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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