Basic information
- Standard SMILES
O=[N+]([O-])c1ccc(OC2CCNCC2)c(Br)c1- InChIKey
GFIATOTVRWHPIV-UHFFFAOYSA-N- Molecular formula
- C11H13BrN2O3
- Average molar mass
- 301.14 g/mol
- Monoisotopic mass
- 300.01095
Names & identifiers
- Preferred name
- 4-(2-Bromo-4-nitrophenoxy)piperidine
- IUPAC
- 4-(2-bromo-4-nitrophenoxy)piperidine
Names & synonyms
4-(2-bromo-4-nitrophenoxy)piperidineSCHEMBL12075923GFIATOTVRWHPIV-UHFFFAOYSA-NAKOS011632662
Database identifiers
- PubChem CID
- 62347639
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 67.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 266
Related reactions
2 records
Compound notes
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