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

CAS Registry Number®

1139-52-2
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CAS Name

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

Molecular Formula

C14H21BrO

Molecular Mass

285.22

Cite this Page

4-Bromo-2,6-di-tert-butylphenol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1139-52-2 (retrieved 2024-04-18) (CAS RN: 1139-52-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    126-128 °C @ Press: 4 Torr

  • Melting Point (2)

    81 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C14H21BrO/c1-13(2,3)10-7-9(15)8-11(12(10)16)14(4,5)6/h7-8,16H,1-6H3

InChIKey

InChIKey=SSQQUEKFNSJLKX-UHFFFAOYSA-N

SMILES

C(C)(C)(C)C1=C(O)C(C(C)(C)C)=CC(Br)=C1

Canonical SMILES

BrC=1C=C(C(O)=C(C1)C(C)(C)C)C(C)(C)C

Other Names for this Substance

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

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