5-Chloro-1,10-phenanthroline

C₁₂H₇ClN₂CAS 4199-89-7214.65 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₇ClN₂
Molar mass: 214.65 g/mol
Exact mass: 214.0298 Da
Melting point: 123 °C
logP: 3.44Crippen estimate
Polar surface area: 25.8 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Identifiers

CAS number

4199-89-7

SMILES

Clc1cc2cccnc2c2ncccc12

InChIKey

XDUUQOQFSWSZSM-UHFFFAOYSA-N

InChI

InChI=1S/C12H7ClN2/c13-10-7-8-3-1-5-14-11(8)12-9(10)4-2-6-15-12/h1-7H

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

Names and synonyms

3 names

1,10-Phenanthroline, 5-chloro-
5-Chloro-1,10-diazaphenanthrene
5-Chloro-o-phenanthroline

Work with 5-Chloro-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-Chloroquinoline611-33-662 % similar Chloroxine773-76-259 % similar 5-Methyl-1,10-phenanthroline3002-78-658 % similar 5-Bromo-1,10-phenanthroline40000-20-258 % similar 4,8-Dichloroquinoline21617-12-955 % similar Clioquinol130-26-753 % similar 5-Chloro-7-bromo-8-hydroxyquinoline7640-33-753 % similar 5-Chloro-8-hydroxyquinoline130-16-551 % similar

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

Same formula

2-Chloro-6-phenyl-3-pyridinecarbonitrile43083-14-3 2-Chloro-1,10-phenanthroline7089-68-1

Elsewhere

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