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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
Quality Level
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)
Regulatory Information
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"New ruthenium catalysts containing chiral Schiff bases for the asymmetric hydrogenation of acetophenone"
Karame I, et al.
Tetrahedron Asymmetry, 15(10), 1569-1581 (2004)
"Synthesis, conformational interconversion, and photophysics of tethered porphyrin?fullerene dyads with parachute topology"
Fazio.AM, et al.
Chemistry?A European Journal , 15(31), 7698-7705 (2009)
"A Self-Assembled Porphyrin Box from meso?meso-Linked Bis {5-p-pyridyl-15-(3, 5-di-octyloxyphenyl) porphyrinato zinc (II)}"
Tsuda A, et al.
Angewandte Chemie (Weinheim an der Bergstrasse, Germany), 114(15), 2941-2945 (2002)
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 574589-1G | 04061825586533 |
| 574589-5G | 04061832628042 |