Calcium bis[amino(4-hydroxy-3-iodophenyl)acetate]
Basic information
- CAS
7681-60-9- Standard SMILES
NC(C(=O)[O-])c1ccc(O)c(I)c1.NC(C(=O)[O-])c1ccc(O)c(I)c1.[Ca+2]- InChIKey
LBPIOPZRLWTGRQ-UHFFFAOYSA-L- Molecular formula
- C16H14CaI2N2O6
- Average molar mass
- 624.18 g/mol
- Monoisotopic mass
- 623.85672
Names & identifiers
- Preferred name
- Calcium bis[amino(4-hydroxy-3-iodophenyl)acetate]
- IUPAC
- calcium bis(2-amino-2-(4-hydroxy-3-iodophenyl)acetate)
Names & synonyms
7681-60-9DTXSID50703731Calcium bis[amino(4-hydroxy-3-iodophenyl)acetate]
Database identifiers
- CAS
7681-60-9- PubChem CID
- 53471740
- DTXSID
DTXSID50703731
Properties
Computed structural properties
- Topological polar surface area
- 173 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 194
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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