3,5-Dibromo-4-methylphenol

C₇H₆Br₂OCAS 13979-81-2265.93 g/mol

Open in Covalent MOL file

Aryl halide Phenol

Properties

Molecular formula: C₇H₆Br₂O
Molar mass: 265.93 g/mol
Exact mass: 263.8785 Da
Melting point: 97 °C
Boiling point: 280–286 °C
logP: 3.23Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Identifiers

CAS number

13979-81-2

SMILES

Cc1c(Br)cc(O)cc1Br

InChIKey

AXCQKKVGMZCWPC-UHFFFAOYSA-N

InChI

InChI=1S/C7H6Br2O/c1-4-6(8)2-5(10)3-7(4)9/h2-3,10H,1H3

Weigh it out

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

Names and synonyms

3 names

Phenol, 3,5-dibromo-4-methyl-
p-Cresol, 3,5-dibromo-
3,5-Dibromo-p-cresol

Work with 3,5-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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,4,6-Tribromotoluene6320-40-757 % similar 3,5-Dibromo-4-methylaniline13194-73-552 % similar 2,4,6-Tribromo-3-methylphenol4619-74-350 % similar 3,5-Dibromo-4-methylbenzoic acid67973-32-447 % similar 4-Bromo-3-methylphenol14472-14-146 % similar 4-Bromo-3,5-dimethylphenol7463-51-646 % similar 2-Bromo-1,4-benzenediol583-69-744 % similar 3,5-Dibromo-4-methylpyridine3430-23-744 % similar

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

Same formula

(3,5-Dibromophenyl)methanol145691-59-4 2,4-Dibromoanisole21702-84-1 2,6-Dibromo-4-methylphenol2432-14-6 2,4-Dibromobenzenemethanol666747-06-4 1,3-Dibromo-5-methoxybenzene74137-36-3

Elsewhere

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