Basic information
- Standard SMILES
CCCCNc1cc(F)cc(OCCCN(CC)CC)c1[N+](=O)[O-]- InChIKey
BBXHBXHAHNRHHI-UHFFFAOYSA-N- Molecular formula
- C17H28FN3O3
- Average molar mass
- 341.4 g/mol
Names & identifiers
- Preferred name
- 2-n-Butylamino-6-(3-diethylaminopropoxy)-4-fluoronitrobenzene
- IUPAC
- N-butyl-3-[3-(diethylamino)propoxy]-5-fluoro-2-nitroaniline
Names & synonyms
SCHEMBL1283784BBXHBXHAHNRHHI-UHFFFAOYSA-N2-n-butylamino-6-(3-diethylaminopropoxy)-4-fluoronitrobenzene
Database identifiers
- PubChem CID
- 66977481
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 70.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 350
Related reactions
4 records
Compound notes
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