3,7-Phenanthroline-8-carbaldehyde
Basic information
- CAS
65990-95-6- Standard SMILES
O=Cc1ccc2c(ccc3cnccc32)n1- InChIKey
ZIBRLIXNWIEDDI-UHFFFAOYSA-N- Molecular formula
- C13H8N2O
- Average molar mass
- 208.21 g/mol
- Monoisotopic mass
- 208.06366288
Names & identifiers
- Preferred name
- 3,7-Phenanthroline-8-carbaldehyde
- IUPAC
- 3,7-phenanthroline-8-carbaldehyde
Names & synonyms
3,7-PHENANTHROLINE-8-CARBALDEHYDE65990-95-6DTXSID40792912
Database identifiers
- CAS
65990-95-6- PubChem CID
- 71369907
- DTXSID
DTXSID40792912
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 42.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 269
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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