4,7-Dichloro-1,10-phenanthroline

C₁₂H₆Cl₂N₂CAS 5394-23-0249.09 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₆Cl₂N₂
Molar mass: 249.09 g/mol
Exact mass: 247.9908 Da
Melting point: 249–250 °C
logP: 4.09Crippen estimate
Polar surface area: 25.8 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Identifiers

CAS number

5394-23-0

SMILES

Clc1ccnc2c1ccc1c(Cl)ccnc12

InChIKey

GIEQBYJCGYHHSU-UHFFFAOYSA-N

InChI

InChI=1S/C12H6Cl2N2/c13-9-3-5-15-11-7(9)1-2-8-10(14)4-6-16-12(8)11/h1-6H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names

1,10-Phenanthroline, 4,7-dichloro-
4,7-Dichloro-o-phenanthroline
NSC 626

Work with 4,7-Dichloro-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

4,8-Dichloroquinoline21617-12-971 % similar 4-Chloro-8-(trifluoromethyl)quinoline23779-97-755 % similar 4-Chloroquinoline611-35-852 % similar 5-Chloro-1,10-phenanthroline4199-89-750 % similar 5-Chloro-8-hydroxyquinoline130-16-548 % similar 4,7-Dimethyl-1,10-phenanthroline3248-05-346 % similar 4-Chloro-7-(trifluoromethyl)quinoline346-55-444 % similar 4-Chloro-6-methylquinoline18436-71-044 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2,9-Dichloro-1,10-phenanthroline29176-55-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook