2,3,5,6-Tetrachlorophenol

C₆H₂Cl₄OCAS 935-95-5231.88 g/mol

Open in Covalent MOL file

Aryl halide Phenol

Properties

Molecular formula: C₆H₂Cl₄O
Molar mass: 231.88 g/mol
Exact mass: 229.8860 Da
Density: 1.6 g/mL (at 60 °C)
Melting point: 115 °C
logP: 4.01Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Identifiers

CAS number

935-95-5

SMILES

Oc1c(Cl)c(Cl)cc(Cl)c1Cl

InChIKey

KEWNKZNZRIAIAK-UHFFFAOYSA-N

InChI

InChI=1S/C6H2Cl4O/c7-2-1-3(8)5(10)6(11)4(2)9/h1,11H

Weigh it out

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

Names and synonyms

2 names

Phenol, 2,3,5,6-tetrachloro-
NSC 407823

Work with 2,3,5,6-Tetrachlorophenol

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

Hexachlorophene70-30-460 % similar 2,3,6-Trichlorophenol933-75-559 % similar Pentachlorobenzene608-93-558 % similar Tetrachloro-P-hydroquinone87-87-656 % similar 3,4,5-Trichlorophenol609-19-855 % similar Pentachlorophenol87-86-553 % similar 2,3,5-Trichloro-6-hydroxybenzoic acid40932-60-350 % similar 2,3,5,6-Tetrachloroaniline3481-20-748 % similar

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

Same formula

2,3,4,5-Tetrachlorophenol4901-51-3 2,3,4,6-Tetrachlorophenol58-90-2

Elsewhere

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