Basic information
- CAS
15473-28-6- Standard SMILES
O=[N+]([O-])CCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]- InChIKey
BNRFBLVJDTYMDV-UHFFFAOYSA-N- Molecular formula
- C3H4N4O8
- Average molar mass
- 224.09 g/mol
- Monoisotopic mass
- 224.0029131
Names & identifiers
- Preferred name
- Propane, 1,1,1,3-tetranitro-
- IUPAC
- 1,1,1,3-tetranitropropane
Names & synonyms
1,1,1,3-TetranitropropanePropane, 1,1,1,3-tetranitro-15473-28-6GQ23MN7LO0NSC 312451BRN 1802334UNII-GQ23MN7LO0NSC-312451DTXSID101657104-01-00-00235 (Beilstein Handbook Reference)RefChem:176274DTXCID5088201
Show more names
NSC312451Propane,1,1,1,3-tetranitro-DS-012279
Database identifiers
- CAS
15473-28-6- PubChem CID
- 100522
- DTXSID
DTXSID10165710- UNII
- GQ23MN7LO0
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 183 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 266
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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