Einecs 274-148-1
Basic information
- CAS
69847-36-5- Standard SMILES
Cc1ccc(N=Nc2c([O-])c(C(=O)[O-])cc3ccccc23)c(S(=O)(=O)[O-])c1.[H+].[Mn+2]- InChIKey
YNTQMNBONRIZCJ-UHFFFAOYSA-L- Molecular formula
- C18H12MnN2O6S
- Average molar mass
- 439.3 g/mol
- Monoisotopic mass
- 438.97965
Names & identifiers
- Preferred name
- Einecs 274-148-1
- IUPAC
- hydron;manganese(2+);4-[(4-methyl-2-sulfonatophenyl)diazenyl]-3-oxidonaphthalene-2-carboxylate
Names & synonyms
EINECS 274-148-169847-36-5Hydrogen (3-hydroxy-4-((4-methyl-2-sulphophenyl)azo)naphthalene-2-carboxylato(3-))manganate(1-)
Database identifiers
- CAS
69847-36-5- PubChem CID
- 112309
- EC Number
- 274-148-1
Properties
Computed structural properties
- Topological polar surface area
- 153 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 657
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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