2-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine
Basic information
- CAS
102830-72-8- Standard SMILES
Clc1ccc(C2CCc3cccnc3O2)cc1Cl- InChIKey
ZGZXPGYGYRATEU-UHFFFAOYSA-N- Molecular formula
- C14H11Cl2NO
- Average molar mass
- 280.1 g/mol
- Monoisotopic mass
- 279.0217694
Names & identifiers
- Preferred name
- 2-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine
- IUPAC
- 2-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine
Names & synonyms
102830-72-82-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine2H-Pyrano(2,3-b)pyridine, 2-(3,4-dichlorophenyl)-3,4-dihydro-2H-Pyrano[2,3-b]pyridine, 2-(3,4-dichlorophenyl)-3,4-dihydro-CHEMBL448414SCHEMBL9672699DTXSID60908073
Database identifiers
- CAS
102830-72-8- PubChem CID
- 514904
- DTXSID
DTXSID60908073- ChEMBL
CHEMBL448414
Properties
Computed structural properties
- XLogP
- 4.3
- 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
- 289
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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