4,7-Dihydroxy-1,10-phenanthroline

C12H8N2O2CAS 3922-40-5212.21 g/mol

Open in Covalent MOL file
OHNONH

Properties

Molecular formula
C12H8N2O2
Molar mass
212.21 g/mol
Exact mass
212.0586 Da
Melting point
475 °C (decomposes)
logP
1.37Crippen estimate
Polar surface area
65.7 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
3922-40-5
SMILES
O=c1cc[nH]c2c1ccc1c(=O)cc[nH]c12
InChIKey
SLIBCJURSADKPV-UHFFFAOYSA-N
InChI
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)

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Names and synonyms

1 names
  • 1,10-Phenanthroline-4,7-diol

Work with 4,7-Dihydroxy-1,10-phenanthroline

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

8-Fluoro-4-hydroxyquinoline63010-71-959 % similar 4-Hydroxyquinoline611-36-952 % similar 7-Bromoquinolin-4-ol82121-06-048 % similar 7-Chloro-4-hydroxyquinoline86-99-748 % similar 4-Hydroxy-7-(trifluoromethyl)quinoline322-97-444 % similar 7-Methoxyquinolin-4-ol82121-05-944 % similar 6-Bromo-4-hydroxyquinoline145369-94-444 % similar 6-Fluoroquinolin-4-ol391-78-644 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,2'-Bipyridyl-5,5'-dialdehyde135822-72-9 2-Nitrocarbazole14191-22-1 2,2′-Pyridil492-73-9 2,2'-Bipyridine-6,6'-dicarbaldehyde49669-26-3 2 2'-Bipyridine-4 4'-dicarboxaldehyde99970-84-0

Elsewhere

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