Basic information
- CAS
61275-47-6- Standard SMILES
CCC(C)(C)c1ccc(O)c(N=Nc2cc([N+](=O)[O-])ccc2O)c1.O=S(=O)(O)c1cccc(N=Nc2ccc(O)c(N=Nc3c(O)ccc4ccccc34)c2)c1.[Cr].[Na+].[Na+]- InChIKey
UTPJAMJQCVMTJX-UHFFFAOYSA-N- Molecular formula
- C39H35CrN7Na2O9S+2
- Average molar mass
- 875.8 g/mol
- Monoisotopic mass
- 875.14174
Names & identifiers
- Preferred name
- Disodium (3-((4-hydroxy-3-((2-hydroxy-1-naphthyl)azo)phenyl)azo)benzenesulphonato(3-))(2-((2-hydroxy-5-nitrophenyl)azo)-4-tert-pentylphenolato(2-))chromate(2-)
- IUPAC
- disodium;chromium;3-[[4-hydroxy-3-[(2-hydroxynaphthalen-1-yl)diazenyl]phenyl]diazenyl]benzenesulfonic acid;2-[(2-hydroxy-5-nitrophenyl)diazenyl]-4-(2-methylbutan-2-yl)phenol
Names & synonyms
EINECS 262-684-961275-47-6Disodium (3-((4-hydroxy-3-((2-hydroxy-1-naphthyl)azo)phenyl)azo)benzenesulphonato(3-))(2-((2-hydroxy-5-nitrophenyl)azo)-4-tert-pentylphenolato(2-))chromate(2-)
Database identifiers
- CAS
61275-47-6- PubChem CID
- 136192528
- EC Number
- 262-684-9
Properties
Computed structural properties
- Topological polar surface area
- 264 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 15
- Rotatable bonds
- 2
- Heavy atoms
- 59
- Formal charge
- 2
- Complexity
- 1,460
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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