3H-Imidazo(4,5-b)pyridine, 3-(4-chlorophenyl)-
Basic information
- CAS
132458-91-4- Standard SMILES
Clc1ccc(-n2cnc3cccnc32)cc1- InChIKey
QYAXUWDKMUDVRC-UHFFFAOYSA-N- Molecular formula
- C12H8ClN3
- Average molar mass
- 229.66 g/mol
- Monoisotopic mass
- 229.040675
Names & identifiers
- Preferred name
- 3H-Imidazo(4,5-b)pyridine, 3-(4-chlorophenyl)-
- IUPAC
- 3-(4-chlorophenyl)imidazo[4,5-b]pyridine
- English name
- 3-(4-Chlorophenyl)-3H-imidazo(4,5-b)pyridine
- Molecular formula
- C12H8ClN3
- Molecular weight
- 229.66
Names & synonyms
132458-91-43-(4-Chlorophenyl)-3H-imidazo(4,5-b)pyridine3-(4-CHLOROPHENYL)-3H-IMIDAZO[4,5-B]PYRIDINE3H-Imidazo(4,5-b)pyridine, 3-(4-chlorophenyl)-DTXSID70157590RefChem:283130DTXCID50800813-(4-chlorophenyl)imidazo[4,5-b]pyridine3H-Imidazo[4,5-b]pyridine,3-(4-chlorophenyl)-SCHEMBL7835667AKOS0243681473-(4-chlorophenyl)imidazo[5,4-b]pyridine
Show more names
3H-Imidazo[4,5-b]pyridine, 3-(4-chlorophenyl)-
ST51002340AE-842/30158003
Database identifiers
- CAS
132458-91-4- PubChem CID
- 3076804
- DTXSID
DTXSID70157590
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 240
Physicochemical properties
- Melting point
- 135 · 135-139 °C(Solv: hexane (110-54-3); benzene (71-43-2))
- Boiling point
- 401 · 401.0±51.0 °C(Predicted)
- Density
- 1.35 · 1.35±0.1 g/cm3(Predicted)
- pka
- 3.41 · 3.41±0.30(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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