Basic information
- CAS
8069-64-5- Standard SMILES
COC(CNC(=O)NC(=O)CCC(=O)O)[CH2][Hg][n]1cnc2c1c(=O)n(C)c(=O)n2C- InChIKey
UUXWHPPAFYXVSM-UHFFFAOYSA-M- Molecular formula
- C16H22HgN6O7
- Average molar mass
- 610.97 g/mol
- Monoisotopic mass
- 612.125641
Names & identifiers
- Preferred name
- [3-(3-Carboxypropanoylcarbamoylamino)-2-methoxypropyl]-(1,3-dimethyl-2,6-dioxopurin-7-yl)mercury
- IUPAC
- [3-(3-carboxypropanoylcarbamoylamino)-2-methoxypropyl]-(1,3-dimethyl-2,6-dioxopurin-7-yl)mercury
Database identifiers
- CAS
8069-64-5- PubChem CID
- 409273
Properties
Computed structural properties
- Topological polar surface area
- 163 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 708
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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