Basic information
- Standard SMILES
Fc1cc2c(c(C3CCCN3)c1)OCCO2- InChIKey
UXEQOXQYQOWDPN-UHFFFAOYSA-N- Molecular formula
- C12H14FNO2
- Average molar mass
- 223.24 g/mol
Names & identifiers
- Preferred name
- 2-(7-Fluoro-2,3-dihydrobenzo[b][1,4]dioxin-5-yl)pyrrolidine
- IUPAC
- 2-(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)pyrrolidine
Names & synonyms
SCHEMBL15016772SCHEMBL15016880UXEQOXQYQOWDPN-UHFFFAOYSA-N2-(7-fluoro-2,3-dihydrobenzo[b][1,4]dioxin-5-yl)pyrrolidine2-(7-fluoro-2, 3-dihydrobenzo[b] [1,4]dioxin-5-yl)pyrrolidine
Database identifiers
- PubChem CID
- 89618276
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 251
Related reactions
7 records
Linked notes
Loading…