1,10-Phenanthroline-4,7-diol

• Catalog Number: ACM3922405-2
• Product Name: 1,10-Phenanthroline-4,7-diol
• CAS: 3922-40-5
• Category: Heterocyclic Organic Compound
• Synonyms: 4,7-Dihydroxy-1,10-phenanthroline
• IUPAC Name: 1,10-dihydro-1,10-phenanthroline-4,7-dione
• Molecular Weight: 212.20
• Molecular Formula: C12H8N2O2
• Canonical SMILES: C1=CC2=C(C3=C1C(=O)C=CN3)NC=CC2=O
• InChI: SLIBCJURSADKPV-UHFFFAOYSA-N
• InChI Key: InChI=1S/C12H8N2O2/c15-9-3-5-13-11-7(9)1-2-8-10(16)4-6-14-12(8)11/h1-6H,(H,13,15)(H,14,16)
• Boiling Point: 515.8±45.0 °C(Predicted)
• Melting Point: >300 °C (dec.)-lit.
• Appearance: Yellow powder
• Complexity: 362
• Covalently-Bonded Unit Count: 1
• EC Number: 223-493-6
• Exact Mass: 212.058577502
• H-Bond Acceptor: 4
• H-Bond Donor: 2
• Heavy Atom Count: 16
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 2
• Monoisotopic Mass: 212.058577502
• Rotatable Bond Count: 0
• Topological Polar Surface Area: 58.2 Ų