chempirical

2,6-Dibromo-4-methylphenol

C7H6Br2OCAS 2432-14-6265.93 g/mol

Open in Covalent MOL file
BrOHBr
Aryl halidePhenol

Properties

Molecular formula
C7H6Br2O
Molar mass
265.93 g/mol
Exact mass
263.8785 Da
Melting point
49–51 °C
Boiling point
280–286 °C (at 97 Torr)
logP
3.23Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
2432-14-6
SMILES
Cc1cc(Br)c(O)c(Br)c1
InChIKey
FIGPGTJKHFAYRK-UHFFFAOYSA-N
InChI
InChI=1S/C7H6Br2O/c1-4-2-5(8)7(10)6(9)3-4/h2-3,10H,1H3

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Names and synonyms

6 names
  • Phenol, 2,6-dibromo-4-methyl-
  • NSC 76596
  • p-Cresol, 2,6-dibromo-
  • 2,6-Dibromo-p-cresol
  • Dibromocresol
  • 2,6-Dibromo-4-cresol

Work with 2,6-Dibromo-4-methylphenol

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

2,4,6-Tribromophenol118-79-657 % similar 2,6-Dibromo-4-fluorophenol344-20-752 % similar 4-Amino-2,6-dibromophenol609-21-252 % similar 2,6-Dibromo-4-methylaniline6968-24-752 % similar Tetrabromobisphenol A79-94-752 % similar 2,4,6-Tribromoresorcinol2437-49-250 % similar 2,4,6-Tribromo-3-methylphenol4619-74-350 % similar Mesitol527-60-650 % similar

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

Same formula

3,5-Dibromo-4-methylphenol13979-81-2 2,4-Dibromoanisole21702-84-1 2,4-Dibromobenzenemethanol666747-06-4 1,3-Dibromo-5-methoxybenzene74137-36-3

Elsewhere

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