4-tert-Butylcalix[4]arene

4-tert-Butylcalix[4]arene
  • CAS No.:60705-62-6
Other grades of this product :
4-tert-Butylcalix[4]arene Basic information
Product Name:4-tert-Butylcalix[4]arene
Synonyms:P-TERT-BUTYLCALIX[4]ARENE;TETRA-TERT-BUTYL(TETRAHYDROXY)CALIX[4]ARENE;AKOS 43;4-TERT-BUTYLCALIX[4]ARENE;4-T-BUTYLCALIX[4]ARENE;ETHYL 2-([5,11,17,23-TETRA(TERT-BUTYL)-26,27,28-TRIS(2-ETHOXY-2-OXYETHOXY)PENTACYCLO[19.3.1.1(3,7).1(9,13).1(15,19)]OCTACOSA-1(25),3(28),4,6,9(27),10,12,15,17,19,(26),21,23-DODECAEN-25-YL]OXY)ACETATE;LABOTEST-BB LT00453198;4-t-Butylcalix4arene,95%
CAS:60705-62-6
MF:C44H56O4
MW:648.91
EINECS:612-010-8
Product Categories:AlcoholsSynthetic Reagents;Monomers;Macrocycles for Host-Guest Chemistry;Chelation/Complexation Compounds;Synthetic Reagents;Polymer Science;pharmacetical;Calixarenes;Functional Materials
Mol File:60705-62-6.mol
4-tert-Butylcalix[4]arene Chemical Properties
Melting point ≥300 °C(lit.)
Boiling point 636.8°C (rough estimate)
density 0.9543 (rough estimate)
refractive index 1.6400 (estimate)
storage temp. Store below +30°C.
pka9.53±0.20(Predicted)
form Crystalline Powder or Flakes
color White to light beige
Water Solubility Soluble in chloroform, benzene, toluene. Insoluble in water.
BRN 2033965
InChIKeyNVKLTRSBZLYZHK-UHFFFAOYSA-N
CAS DataBase Reference60705-62-6(CAS DataBase Reference)
Safety Information
Risk Statements 36/37/38
Safety Statements 22-24/25
WGK Germany 3
HS Code 29072990
MSDS Information
ProviderLanguage
SigmaAldrich English
ACROS English
ALFA English
4-tert-Butylcalix[4]arene Usage And Synthesis
Chemical PropertiesWhite to light beige crystalline powder or flakes
UsesIt is used as a starting material for further derivatization, including halogenation, acylation, and diazo coupling.
Purification MethodsThe calixarene recrystallises from CHCl3 in large solvated prisms (m 380o dec); it effloresces on drying in air. Its tetra-acetate crystallises from Ac2O in colourless prisms m 332-333o(dec). It crystallises from CCl4 or chlorobenzene /EtOH (m >300o) and the tetra-acetate crystallises from CHCl3/EtOH m >290o(dec). It also crystallises from toluene in white plates with toluene of crystallisation m 344-346o (330-332o); the tetra-acetate crystallises with 1AcOH of crystallisation m 383-386o (softening at 330-340o, also m 283-286o), but acetylation with Ac2O/NaOAc gives the triacetate which recrystallises from AcOH with 1AcOH of crystallisation m 278-281o. 4-tert-Butylcalix[4]arene (100mg) is unchanged after boiling for 4hours with 10N KOH (0.04mL) in xylene (4mL). [Br J Pharmacol 10 73 1955, K.mmerer et al. Monatsh Chem 109 767 1978, 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.]
4-tert-Butylcalix[4]arene Preparation Products And Raw materials

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