2-Bromo-4,6-di-tert-butylphenol

C14H21BrOCAS 20834-61-1285.22 g/mol

Open in Covalent MOL file
BrOH
Aryl halidePhenol

Properties

Molecular formula
C14H21BrO
Molar mass
285.22 g/mol
Exact mass
284.0776 Da
Melting point
59–61 °C
Boiling point
141–142 °C
logP
4.75Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
20834-61-1
SMILES
CC(C)(C)c1cc(Br)c(O)c(C(C)(C)C)c1
InChIKey
DIWZVAHZEOFSLS-UHFFFAOYSA-N
InChI
InChI=1S/C14H21BrO/c1-13(2,3)9-7-10(14(4,5)6)12(16)11(15)8-9/h7-8,16H,1-6H3

Weigh it out

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

Names and synonyms

7 names
  • Phenol, 2-bromo-4,6-bis(1,1-dimethylethyl)-
  • Phenol, 2-bromo-4,6-di-tert-butyl-
  • 2-Bromo-4,6-bis(1,1-dimethylethyl)phenol
  • 2-Bromo-4,6-bis(tert-butyl)phenol
  • 4,6-Di(tert-butyl)-2-bromophenol
  • 6-Bromo-2,4-tert-butylphenol
  • 2-Bromo-4,6-ditert-butylphenol

Work with 2-Bromo-4,6-di-tert-butylphenol

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-Tri-tert-butylphenol732-26-370 % similar 3,3′,5,5′-Tetrakis(1,1-dimethylethyl)[1,1′-biphenyl]-2,2′-diol6390-69-863 % similar 3,5-Di-tert-butylcatechol1020-31-161 % similar Tetrabromobisphenol A79-94-755 % similar 2-Bromo-4-tert-butylphenol2198-66-555 % similar 3,5-Di-tert-butylsalicylaldehyde37942-07-753 % similar 4-Chloro-3,5-dibromo-tert-butylbenzene1000578-25-550 % similar 3,5-Bis(1,1-dimethylethyl)-2-hydroxybenzoic acid19715-19-650 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Bromo-2,6-di-tert-butylphenol1139-52-2 p-Bromophenyl octyl ether96693-05-9

Elsewhere

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