2H-Pyrano(2,3-b)pyridine, 6-bromo-3,4-dihydro-2-(4-methylphenyl)-
Basic information
- CAS
102830-66-0- Standard SMILES
Cc1ccc(C2CCc3cc(Br)cnc3O2)cc1- InChIKey
JVZXWZXGTDWIQW-UHFFFAOYSA-N- Molecular formula
- C15H14BrNO
- Average molar mass
- 304.18 g/mol
- Monoisotopic mass
- 303.02588
Names & identifiers
- Preferred name
- 2H-Pyrano(2,3-b)pyridine, 6-bromo-3,4-dihydro-2-(4-methylphenyl)-
- IUPAC
- 6-bromo-2-(4-methylphenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine
Names & synonyms
102830-66-02H-Pyrano(2,3-b)pyridine, 6-bromo-3,4-dihydro-2-(4-methylphenyl)-2H-Pyrano[2,3-b]pyridine, 6-bromo-3,4-dihydro-2-(4-methylphenyl)-6-bromo-2-(4-methylphenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridineCHEMBL287911SCHEMBL9672472DTXSID509080676-bromo-2-(p-tolyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine
Database identifiers
- CAS
102830-66-0- PubChem CID
- 514899
- DTXSID
DTXSID50908067- ChEMBL
CHEMBL287911
Properties
Computed structural properties
- XLogP
- 4.1
- 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
- 278
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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