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Basic information
- Standard SMILES
Nc1ccc(CP2(=O)CCCCC2)cc1- InChIKey
YBMSHSPKIMCCEV-UHFFFAOYSA-N- Molecular formula
- C12H18NOP
- Average molar mass
- 223.25 g/mol
Names & identifiers
- Preferred name
- 1-(4-Aminobenzyl)phosphorinane-1-oxide
- IUPAC
- 4-[(1-oxo-1λ5-phosphinan-1-yl)methyl]aniline
Names & synonyms
SCHEMBL5209360YBMSHSPKIMCCEV-UHFFFAOYSA-N1-(4-aminobenzyl)phosphorinane-1-oxide1-(4-aminobenzyl)-phosphorinane-1-oxide
Database identifiers
- PubChem CID
- 22989986
Properties
Computed structural propertiesFilling in
- XLogP
- 1
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 236
Related reactions
10 records
Compound notes
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