C1=CC2=C(C3=C(C=CC=N3)C(=O)C2=O)N=C1
CAS: 27318-90-7
Name: 1,10-phenanthroline-5,6-dione
SMILES: C1=CC2=C(C3=C(C=CC=N3)C(=O)C2=O)N=C1

Molecular Processing

Molecular formula
C12H6N2O2
Molecular weight
210.19
Exact mass
210.0429
XLogP
1.52
TPSA
59.92
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
16
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
56.13

Supplementary Information

InChIKey: KCALAFIVPCAXJI-UHFFFAOYSA-N
Synonyme
1,10-Phenanthroline-5,6-dione27318-90-7phendioneLDN-737948JD7KXA2W01,10-PadNSC-346882DTXSID60181763phen-dioneRefChem:410366DTXCID00104254627-684-9MFCD000144731 10-PHENANTHROLINE-5 6-DIONE 975,6-dihydro-1,10-phenanthroline-5,6-dioneNSC346882MLS003171048T5-8pyridino[3,2-h]quinoline-5,6-dione[1,10]Phenanthroline-5,6-dione1 10-PHENANTHROLINE-5 6-DIONEStahl phd oxidant1,10-phenanthroline-5,6-quinoneNSC 346882UNII-8JD7KXA2W01,10-phenanthrolinequinonecid_72810SCHEMBL460433CHEMBL235504SCHEMBL29419580
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