Basic information
- Standard SMILES
CN(CC(=O)O)C(=N)N.O=[N+]([O-])O.O=[N+]([O-])O.O=[N+]([O-])O- InChIKey
PUJRKBTWOFNQBY-UHFFFAOYSA-N- Molecular formula
- C4H12N6O11
- Average molar mass
- 320.17 g/mol
Names & identifiers
- Preferred name
- Creatine Trinitrate
- IUPAC
- 2-[carbamimidoyl(methyl)amino]acetic acid;tris(nitric acid)
Names & synonyms
Creatine TrinitrateSCHEMBL2513564PUJRKBTWOFNQBY-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 86628845
Properties
Computed structural properties
- Topological polar surface area
- 289 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 159
Related reactions
7 records
Compound notes
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