Basic information
- CAS
102830-80-8- Standard SMILES
Clc1ccc(C2C=Cc3cc(Cl)cnc3O2)cc1- InChIKey
OQPYITHHFVRREP-UHFFFAOYSA-N- Molecular formula
- C14H9Cl2NO
- Average molar mass
- 278.1 g/mol
- Monoisotopic mass
- 277.0061193
Names & identifiers
- Preferred name
- 6-chloro-2-(4-chlorophenyl)-2H-pyrano[2,3-b]pyridine
- IUPAC
- 6-chloro-2-(4-chlorophenyl)-2H-pyrano[2,3-b]pyridine
Names & synonyms
102830-80-86-chloro-2-(4-chlorophenyl)-2H-pyrano[2,3-b]pyridine2H-Pyrano(2,3-b)pyridine, 6-chloro-2-(4-chlorophenyl)-2H-Pyrano[2,3-b]pyridine, 6-chloro-2-(4-chlorophenyl)-CHEMBL288617SCHEMBL9674201DTXSID40908076
Database identifiers
- CAS
102830-80-8- PubChem CID
- 514907
- DTXSID
DTXSID40908076- ChEMBL
CHEMBL288617
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 22.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 315
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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