4-TERT-BUTYLCALIX[6]ARENE
- CAS NO.：78092-53-2
- Empirical Formula: C66H84O6
- Molecular Weight: 973.37
- MDL number: MFCD00075464
- SAFETY DATA SHEET (SDS)
- Update Date: 2025-07-04 15:03:04
![4-TERT-BUTYLCALIX[6]ARENE Structural](https://img.chemicalbook.in/CAS/GIF/78092-53-2.gif)
What is 4-TERT-BUTYLCALIX[6]ARENE?
Chemical properties
WHITE FINE CRYSTALLINE POWDER
The Uses of 4-TERT-BUTYLCALIX[6]ARENE
Starting material for further derivatization, including halogenation, acylation, and diazo coupling.
Definition
ChEBI: 5,11,17,23,29,35-hexa-tert-butylcalix[6]arene-37,38,39,40,41,42-hexol is a substituted calixarene. It derives from a hydride of a calix[6]arene.
Purification Methods
It is recrystallised from CHCl3 or CHCl3/MeOH to give a white solid from the mother liquors of the calix[8]arene preparation. The hexa-acetate (Ac2O/H2SO4) crystallises from CHCl3/MeOH with m 360-362o(dec), and the (SiMe3)6 derivative crystallises from CHCl3/MeOH with m 410-412o. Its stability in KOH-xylene is the same as for the 4-tert-butylcalix[4]arene. [Gutsche et al.J Am Chem Soc 103 3782 1981. See also Kluawer in Calixarenes, Vicens & B.hner eds Academic Press 1991, Beilstein 6 IV 7858.]
Properties of 4-TERT-BUTYLCALIX[6]ARENE
| Melting point: | ≥300 °C(lit.) |
| Boiling point: | 784.26°C (rough estimate) |
| Density | 0.9131 (rough estimate) |
| refractive index | 1.6000 (estimate) |
| storage temp. | Store below +30°C. |
| form | powder to crystal |
| pka | 9.35±0.20(Predicted) |
| color | White to Almost white |
| Water Solubility | <9.73mg/L(temperature not stated) |
| λmax | 286nm(CH3CN)(lit.) |
| BRN | 2611918 |
Safety information for 4-TERT-BUTYLCALIX[6]ARENE
| Signal word | Danger |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P304+P340:IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. P405:Store locked up. |
Computed Descriptors for 4-TERT-BUTYLCALIX[6]ARENE
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![p-tert-Butylcalix(8)arene ,4-TERT-BUTYLCALIX(8)ARENE 95%,4-TERT-BUTYLCALIX[8]ARENE](https://img.chemicalbook.in/CAS/GIF/68971-82-4.gif)
![1,3-DIMETHOXY-4-TERT-BUTYLCALIX(4)ARENE,1,3-DIMETHOXY-4-TERT-BUTYLCALIX[4]ARENE 99%](https://img.chemicalbook.in/CAS/GIF/122406-45-5.gif)
![4-TERT-BUTYLCALIX[4]ARENE TETRAACETIC ACID](https://img.chemicalbook.in/StructureFile/ChemBookStructure4/GIF/CB1775819.gif)
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