chempirical

2,6-Dichloroquinone-4-chloroimide

C6H2Cl3NOCAS 101-38-2210.44 g/mol

Open in Covalent MOL file
OClNClCl
AlkeneImineKetoneVinyl halide

Properties

Molecular formula
C6H2Cl3NO
Molar mass
210.44 g/mol
Exact mass
208.9202 Da
Melting point
66 °C
logP
2.41Crippen estimate
Polar surface area
29.4 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Identifiers

CAS number
101-38-2
SMILES
O=C1C(Cl)=CC(=NCl)C=C1Cl
InChIKey
YHUMTHWQGWPJOQ-UHFFFAOYSA-N
InChI
InChI=1S/C6H2Cl3NO/c7-4-1-3(10-9)2-5(8)6(4)11/h1-2H

Weigh it out

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

Names and synonyms

19 names · show all
  • 2,5-Cyclohexadien-1-one, 2,6-dichloro-4-(chloroimino)-
  • p-Benzoquinone imine, N,2,6-trichloro-
  • 2,6-Dichloro-4-(chloroimino)-2,5-cyclohexadien-1-one
  • Gibbs' reagent
  • N,2,6-Trichlorobenzoquinone imine
  • 2,6-Dichloroquinone chloroimide
  • 2,6-Dichloroquinone-4-chloroimine
  • 2,6-Dichloro-4-N-chloroquinonimine
  • N,2,6-Trichloro-p-benzoquinoneimine
  • 2,6-Dichlorobenzoquinone chloroimide
  • N,2,6-Trichloro-p-benzoquinonimine
  • 2,6-Dichloroquinonechloroimine
  • Named reagents and solutions, Gibbs'
  • 2,6-Dichloroquinone chlorimide
  • 2,6-Dichloro-p-benzoquinone-4-chlorimide
  • 2,6-Dichlorobenzoquinone-4-chloroimine
  • 2,6-Dichlorobenzoquinone N-chloroimine
  • NSC 6293
  • 2,6-Dichloro-4-(chloroimino)cyclohexa-2,5-dienone

Work with 2,6-Dichloroquinone-4-chloroimide

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

2,6-Dichloro-1,4-benzoquinone697-91-652 % similar 2,6-Dichloroindophenol sodium620-45-141 % similar 2,5-Dichloro-1,4-benzoquinone615-93-035 % similar

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

Elsewhere

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