chempirical

2,4-Dichloro-3,5-dimethylphenol

C8H8Cl2OCAS 133-53-9191.05 g/mol

Open in Covalent MOL file
OHClCl
Aryl halidePhenol

Properties

Molecular formula
C8H8Cl2O
Molar mass
191.05 g/mol
Exact mass
189.9952 Da
Melting point
95–96 °C
logP
3.32Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
133-53-9
SMILES
Cc1cc(O)c(Cl)c(C)c1Cl
InChIKey
IYOLBFFHPZOQGW-UHFFFAOYSA-N
InChI
InChI=1S/C8H8Cl2O/c1-4-3-6(11)8(10)5(2)7(4)9/h3,11H,1-2H3

Weigh it out

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

Names and synonyms

11 names
  • Phenol, 2,4-dichloro-3,5-dimethyl-
  • 3,5-Xylenol, 2,4-dichloro-
  • Decasept
  • 2,4-Dichloro-3,5-xylenol
  • Dichloroxylenol
  • DCMX
  • Dixol
  • Hewsol
  • Prinsyl
  • NSC 9774
  • Dichlorometaxylenol

Work with 2,4-Dichloro-3,5-dimethylphenol

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

3-Chloro-6-hydroxy-2,4-dimethylbenzaldehyde81322-67-061 % similar Chloroxylenol88-04-050 % similar 2,5-Dimethylhydroquinone615-90-748 % similar Trimethylhydroquinone700-13-047 % similar Dimethylphenol1300-71-643 % similar 2,3-Dimethylphenol526-75-043 % similar 3-Chloro-2-methylphenol3260-87-542 % similar 2,3,5-Trimethylphenol697-82-542 % similar

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

Same formula

1-Chloro-4-(2-chloroethoxy)benzene13001-28-0 2,6-Dichlorobenzeneethanol30595-79-0 1,3-Dichloro-2-(methoxymethyl)benzene33486-90-7 2,6-Dichloro-α-methylbenzenemethanol53066-19-6

Elsewhere

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