Basic information
- CAS
408-08-2- Standard SMILES
O=[N+]([O-])CCCCCCF- InChIKey
OQVYNPDNUMJKRL-UHFFFAOYSA-N- Molecular formula
- C6H12FNO2
- Average molar mass
- 149.16 g/mol
- Monoisotopic mass
- 149.08520679
Names & identifiers
- Preferred name
- Hexane, 6-fluoro-1-nitro-
- IUPAC
- 1-fluoro-6-nitrohexane
- English name
- 1-Fluoro-6-nitrohexane
- Molecular weight
- 0
Names & synonyms
408-08-26-Fluoro-1-nitrohexaneHEXANE, 6-FLUORO-1-NITRO-BRN 1756603DTXSID00193784RefChem:347610DTXCID401162751-fluoro-6-nitrohexane
Database identifiers
- CAS
408-08-2- PubChem CID
- 9852
- DTXSID
DTXSID00193784- Nikkaji
- J49.401A
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 92.2
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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