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Merck
CN

140406

3,5-Ditert-butyl-4-hydroxybenzaldehyde

99%

Synonym(s):

2,6-Di-tert-Butyl-4-formylphenol, 3,5-Di-tert-butyl-4-hydroxybenzaldehyde

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About This Item

Empirical Formula (Hill Notation):
C15H22O2
CAS Number:
Molecular Weight:
234.33
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
216-592-0
MDL number:
Assay:
99%
Form:
solid
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Quality Level

assay

99%

form

solid

solubility

ethanol: soluble 50 mg/mL, clear to slightly hazy (yellow to orange to light red-brown)

functional group

aldehyde

SMILES string

CC(C)(C)c1cc(C=O)cc(c1O)C(C)(C)C

InChI

1S/C15H22O2/c1-14(2,3)11-7-10(9-16)8-12(13(11)17)15(4,5)6/h7-9,17H,1-6H3

InChI key

DOZRDZLFLOODMB-UHFFFAOYSA-N

Application

3,5-Di-tert-butyl-4-hydroxybenzaldehyde can be used as a starting material to synthesize:

  • Biodegradable polyazomethine hydrogels by reacting with melamine via oxidative polymerization reaction.
  • 4-(1H-benzimidazol-2-yl)-2,6-di-tert butyl-phenol by treating with 1,2-phenylenediamine in ethanol.
  • 2-{(3,5-di-tert-butyl-4-hydroxyphenyl)methylene}-4-cyclopentene-1,3-dione (TX-1123) as a potent protein tyrosine kinase inhibitor.
  • Polyazomethine and ascorbic acid-based selective and sensitive fluorescent chemosensor for the detection of Al and Fe metal ions.


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Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves



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Highly stabilized phenoxyl radicals with hydrogen-bonding capability.
Xie C and Lahti PM.
Tetrahedron Letters, 40(23), 4305-4308 (1999)
Hitoshi Hori et al.
Bioorganic & medicinal chemistry, 10(10), 3257-3265 (2002-08-02)
A series of 2-hydroxyarylidene-4-cyclopentene-1,3-diones were designed, synthesized, and evaluated with respect to protein tyrosine kinase (PTK) inhibition, mitochondrial toxicity, and antitumor activity. Our results show that the cyclopentenedione-derived TX-1123 is a more potent antitumor tyrphostin and also shows lower mitochondrial
A dual responsive colorimetric sensor based on polyazomethine and ascorbic acid for the detection of Al (III) and Fe (II) ions
Kamaci UD, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy, 254, 119650-119650 (2021)



Global Trade Item Number

SKUGTIN
140406-25G04061838733429
140406-100G04061831828351