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Merck
CN

574589

3,5-Di-tert-butylbenzaldehyde

97%

Synonym(s):

3,5-Di-tert-butyl-benzaldehyde

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About This Item

Linear Formula:
[(CH3)3C]2C6H3CHO
CAS Number:
Molecular Weight:
218.33
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
97%
Form:
solid
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Quality Segment

assay

97%

form

solid

mp

85-89 °C (lit.)

functional group

aldehyde

SMILES string

CC(C)(C)c1cc(C=O)cc(c1)C(C)(C)C

InChI

1S/C15H22O/c1-14(2,3)12-7-11(10-16)8-13(9-12)15(4,5)6/h7-10H,1-6H3

InChI key

BRUITYMDHWNCIG-UHFFFAOYSA-N

Application

3,5-Di-tert-butylbenzaldehyde may be used in the synthesis of the following:
  • 5-p-pyridyl-15-(3,5-di-tert-butylphenyl)porphyrin via condensation reaction with 4-pyridinecarboxaldehyde and 2,2′-dipyrrylmethane
  • 3,5-di-tert-butylphenyl-dipyrromethane via reaction with pyrrole in the presence of trifluoroacetic acid
  • 3,5-di-tert-butyl-2-nitrobenzaldehyde via nitration reaction


Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)



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