Basic information
- CAS
837374-99-9- Standard SMILES
O=[N+]([O-])C1C([N+](=O)[O-])C1[N+](=O)[O-]- InChIKey
YCAORHCEIBVHIX-UHFFFAOYSA-N- Molecular formula
- C3H3N3O6
- Average molar mass
- 177.07 g/mol
- Monoisotopic mass
- 177.00218482
Names & identifiers
- Preferred name
- 1,2,3-Trinitrocyclopropane
- IUPAC
- 1,2,3-trinitrocyclopropane
Names & synonyms
1,2,3-Trinitrocyclopropane837374-99-9DTXSID50834337
Database identifiers
- CAS
837374-99-9- PubChem CID
- 71414902
- DTXSID
DTXSID50834337
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 137 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 197
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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