Chloroxine

C9H5Cl2NOCAS 773-76-2214.05 g/mol

Open in Covalent MOL file
OHClClN
Aryl halidePhenol

Properties

Molecular formula
C9H5Cl2NO
Molar mass
214.05 g/mol
Exact mass
212.9748 Da
Melting point
179.5 °C
logP
3.25Crippen estimate
Polar surface area
33.1 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 77 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
773-76-2
SMILES
Oc1c(Cl)cc(Cl)c2cccnc12
InChIKey
WDFKMLRRRCGAKS-UHFFFAOYSA-N
InChI
InChI=1S/C9H5Cl2NO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H

Weigh it out

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

Names and synonyms

19 names · show all
  • 8-Quinolinol, 5,7-dichloro-
  • 5,7-Dichloro-8-quinolinol
  • CHQ
  • 5,7-Dichloro-8-hydroxyquinoline
  • 5,7-Dichloroxine
  • 5,7-Dichloro-8-oxyquinoline
  • Dichlorohydroxyquinoline
  • Quesyl
  • Clofuzid
  • Dichloroxin
  • Chloroxyquinoline
  • Endiaron
  • Dichloroquinolinol
  • Quixalin
  • Quinolor
  • 5,7-Dichlorooxine
  • Chlofucid
  • Capitrol
  • NSC 3904

Work with Chloroxine

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

Clioquinol130-26-771 % similar 5-Chloro-7-bromo-8-hydroxyquinoline7640-33-771 % similar Halquinol8067-69-468 % similar 5-Chloro-1,10-phenanthroline4199-89-759 % similar 5-Chloro-8-hydroxyquinoline130-16-557 % similar 2,4-Dichloro-1-naphthol2050-76-256 % similar Chlorquinaldol72-80-053 % similar 4,8-Dichloroquinoline21617-12-952 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3,4-Dichlorobenzoylacetonitrile4640-68-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook