Basic information
- Standard SMILES
CP1(=O)CCN(Cc2cccc(Br)n2)CC1- InChIKey
USUFIFYFDKSMBM-UHFFFAOYSA-N- Molecular formula
- C11H16BrN2OP
- Average molar mass
- 303.14 g/mol
Names & identifiers
- Preferred name
- 1-[(6-Bromopyridin-2-yl)methyl]-4-methyl-1,4-azaphosphinane 4-oxide
- IUPAC
- 1-[(6-bromo-2-pyridinyl)methyl]-4-methyl-1,4λ5-azaphosphinane 4-oxide
Names & synonyms
SCHEMBL3512256USUFIFYFDKSMBM-UHFFFAOYSA-N1-[(6-Bromopyridin-2-yl)methyl]-4-methyl-1,4-azaphosphinane 4-oxide
Database identifiers
- PubChem CID
- 59525655
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 33.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 275
Related reactions
4 records
Compound notes
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