2-Nitro-hex-2-ene
Basic information
- CAS
6065-17-4- Standard SMILES
CCCC=C(C)[N+](=O)[O-]- InChIKey
IPHWNDSKYDRUFO-UHFFFAOYSA-N- Molecular formula
- C6H11NO2
- Average molar mass
- 129.16 g/mol
- Monoisotopic mass
- 129.07897859
Names & identifiers
- Preferred name
- 2-Nitro-hex-2-ene
- IUPAC
- 2-nitrohex-2-ene
Names & synonyms
2-nitro-hex-2-eneSCHEMBL31352147
Database identifiers
- CAS
6065-17-4- PubChem CID
- 22448
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 124
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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