Basic information
- CAS
62587-49-9- Standard SMILES
[Br-].c1cc[n+](CCC2OCCO2)cc1- InChIKey
NVWSVTJZSJKEBF-UHFFFAOYSA-M- Molecular formula
- C10H14BrNO2
- Average molar mass
- 260.13 g/mol
- Monoisotopic mass
- 259.02079
Names & identifiers
- Preferred name
- 1-[2-(1,3-Dioxolan-2-yl)ethyl]pyridin-1-ium bromide
- IUPAC
- 1-[2-(1,3-dioxolan-2-yl)ethyl]pyridin-1-ium bromide
Names & synonyms
62587-49-91-[2-(1,3-Dioxolan-2-yl)ethyl]pyridin-1-ium bromideDTXSID50494834NSC275393NSC-275393
Database identifiers
- CAS
62587-49-9- PubChem CID
- 12371304
- DTXSID
DTXSID50494834
Properties
Computed structural properties
- Topological polar surface area
- 22.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 140
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…