Basic information
- CAS
4812-24-2- Standard SMILES
CCCCC=C(CCC)[N+](=O)[O-]- InChIKey
DWTJGAYPBZHTDX-UHFFFAOYSA-N- Molecular formula
- C9H17NO2
- Average molar mass
- 171.24 g/mol
- Monoisotopic mass
- 171.12592879
Names & identifiers
- Preferred name
- 4-Nitro-non-4-ene
- IUPAC
- 4-nitronon-4-ene
Names & synonyms
4-nitro-non-4-eneDTXSID201032290
Database identifiers
- CAS
4812-24-2- PubChem CID
- 20952
- DTXSID
DTXSID201032290
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 158
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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