Basic information
- CAS
88888-43-1- Standard SMILES
C=CC=CCCCC[N+](=O)[O-]- InChIKey
SHRUXPDMPVTLJG-UHFFFAOYSA-N- Molecular formula
- C8H13NO2
- Average molar mass
- 155.19 g/mol
- Monoisotopic mass
- 155.09462866
Names & identifiers
- Preferred name
- 8-Nitroocta-1,3-diene
- IUPAC
- 8-nitroocta-1,3-diene
Names & synonyms
88888-43-18-Nitroocta-1,3-dieneDTXSID60750438
Database identifiers
- CAS
88888-43-1- PubChem CID
- 71320522
- DTXSID
DTXSID60750438
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 147
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…