2,6-Bis(3-tert-butyl-5-methyl-2-hydroxybenzyl)-4-methylphenol

CAS Registry Number®

90-68-6

CAS Name

2,6-Bis(3-tert-butyl-5-methyl-2-hydroxybenzyl)-4-methylphenol

Molecular Formula

C31H40O3

Molecular Mass

460.65

Cite this Page

2,6-Bis(3-tert-butyl-5-methyl-2-hydroxybenzyl)-4-methylphenol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=90-68-6 (retrieved 2024-11-01) (CAS RN: 90-68-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    154-158 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C31H40O3/c1-18-10-21(16-23-12-19(2)14-25(28(23)33)30(4,5)6)27(32)22(11-18)17-24-13-20(3)15-26(29(24)34)31(7,8)9/h10-15,32-34H,16-17H2,1-9H3

InChIKey

InChIKey=LKALLEFLBKHPTQ-UHFFFAOYSA-N

SMILES

C(C1=C(O)C(CC2=C(O)C(C(C)(C)C)=CC(C)=C2)=CC(C)=C1)C3=C(O)C(C(C)(C)C)=CC(C)=C3

Canonical SMILES

OC=1C(=CC(=CC1CC2=CC(=CC(=C2O)C(C)(C)C)C)C)CC3=CC(=CC(=C3O)C(C)(C)C)C

Other Names for this Substance

  • Phenol, 2,6-bis[[3-(1,1-dimethylethyl)-2-hydroxy-5-methylphenyl]methyl]-4-methyl-
  • Mesitol, α2,α6-bis(5-tert-butyl-6-hydroxy-m-tolyl)-
  • 2,6-Bis[[3-(1,1-dimethylethyl)-2-hydroxy-5-methylphenyl]methyl]-4-methylphenol
  • 2,6-Bis(2-hydroxy-3-tert-butyl-5-methylbenzyl)-4-methylphenol
  • 2,6-Bis(2-hydroxy-3-tert-butyl-5-methylbenzyl)-p-cresol

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CAS INSIGHTSTM
Adam Sanford and Orr Ravitz from CAS