Home Other Building Blocks Calix[6]arene

Calix[6]arene

CAS No.:
96107-95-8
Catalog Number:
AG003OOQ
Molecular Formula:
C42H36O6
Molecular Weight:
636.7316
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>95.0%(HPLC)
1 week
United States
$219
- +
5g
>95.0%(HPLC)
1 week
United States
$609
- +
Product Description
Catalog Number:
AG003OOQ
Chemical Name:
Calix[6]arene
CAS Number:
96107-95-8
Molecular Formula:
C42H36O6
Molecular Weight:
636.7316
MDL Number:
MFCD00143083
IUPAC Name:
heptacyclo[31.3.1.13,7.19,13.115,19.121,25.127,31]dotetraconta-1(37),3(42),4,6,9(41),10,12,15(40),16,18,21,23,25(39),27,29,31(38),33,35-octadecaene-37,38,39,40,41,42-hexol
InChI:
InChI=1S/C42H36O6/c43-37-25-7-1-8-26(37)20-28-10-3-12-30(39(28)45)22-32-14-5-16-34(41(32)47)24-36-18-6-17-35(42(36)48)23-33-15-4-13-31(40(33)46)21-29-11-2-9-27(19-25)38(29)44/h1-18,43-48H,19-24H2
InChI Key:
JLSWUKWFQCVKCL-UHFFFAOYSA-N
SMILES:
Oc1c2cccc1Cc1cccc(c1O)Cc1cccc(c1O)Cc1c(c(Cc3c(c(Cc4c(c(C2)ccc4)O)ccc3)O)ccc1)O
Properties
Complexity:
745  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
636.251g/mol
Formal Charge:
0
Heavy Atom Count:
48  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0
Molecular Weight:
636.744g/mol
Monoisotopic Mass:
636.251g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.4  
Literature
Title Journal
Study on the inclusion behavior of p-sulfonatocalix[6]arene with propranolol by spectrofluorometry. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20121101
Absorption spectrophotometric, NMR and theoretical investigations on ground state non-covalent interaction of C₆₀ and C₇₀ with a designed trihomocalix[6]arene in solution. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20120701
Triazole linked picolylimine conjugate of calix[6]arene as a sequential sensor for La3+ followed by F-. Organic letters 20120615
p-Sulfonated calix[6]arene modified graphene as a 'turn on' fluorescent probe for L-carnitine in living cells. Chemical communications (Cambridge, England) 20120518
Calorimetric study on coordination of tridentate imidazolyl calix[6]arene ligands to zinc ion in organic solvents. Inorganic chemistry 20110704
The extraction of thorium by calix[6]arene columns for urine analysis. Radiation protection dosimetry 20110301
A family of double-bowl pseudo metallocalix[6]arene discs. Dalton transactions (Cambridge, England : 2003) 20100528
Selective functionalization of a single methylene bridge of a calix[6]arene. The Journal of organic chemistry 20100521
Proparacaine complexation with beta-cyclodextrin and p-sulfonic acid calix[6]arene, as evaluated by varied (1)H-NMR approaches. Magnetic resonance in chemistry : MRC 20090901
Molecular recognition and self-assembly special feature: Multipoint molecular recognition within a calix[6]arene funnel complex. Proceedings of the National Academy of Sciences of the United States of America 20090630
Biomimetic and self-assembled calix[6]arene-based receptors for neutral molecules. Organic & biomolecular chemistry 20090621
Replacement of a nitrogen by a phosphorus donor in biomimetic copper complexes: a surprising and informative case study with calix[6]arene-based cryptands. Inorganic chemistry 20090518
Selective hetero-trisfunctionalization of the large rim of a biomimetic calix[6]arene using host-guest chemistry as a synthetic tool. Journal of the American Chemical Society 20081119
Calix[6]tris(thio)ureas: heteroditopic receptors for the cooperative binding of organic ion pairs. The Journal of organic chemistry 20080919
Spectrofluorimetric determination of benzoimidazolic pesticides: effect of p-sulfonatocalix[6]arene and cyclodextrins. Analytica chimica acta 20080822
Dioxygen activation at a mononuclear Cu(I) center embedded in the calix[6]arene-tren core. Journal of the American Chemical Society 20080723
Self-assembly of a double calix[6]arene pseudorotaxane in oriented channels. Chemistry (Weinheim an der Bergstrasse, Germany) 20080101
A ditopic calix[6]arene ligand with N-methylimidazole and 1,2,3-triazole substituents: synthesis and coordination with Zn(II) cations. Organic letters 20071122
Innovative methodologies for the N-protection of N-alkylimidazole groups: application to the first synthesis of a water-soluble calix[6]arene presenting three ammonium substituents at the large rim and three neutral N-donors at the small rim. Organic letters 20070816
Monocopper center embedded in a biomimetic cavity: from supramolecular control of copper coordination to redox regulation. Journal of the American Chemical Society 20070718
Architecture-controlled 'SMART' Calix[6]arene self-assemblies in aqueous solution. Langmuir : the ACS journal of surfaces and colloids 20070424
Insights into the binding properties of a cuprous ion embedded in the tren cap of a calix[6]arene and supramolecular trapping of an intermediate. Dalton transactions (Cambridge, England : 2003) 20070221
Allosteric tuning of the intra-cavity binding properties of a calix[6]arene through external binding to a ZnII center coordinated to amino side chains. Chemistry (Weinheim an der Bergstrasse, Germany) 20070101
Phosphorated calix[6]arene derivatives as an ionophore for atropine-selective membrane electrodes. Journal of AOAC International 20070101
Calix[6]arene derivatives selectively functionalized at alternate sites on the smaller rim with 2-phenylpyridine and 2-fluorenylpyridine substituents to provide deep cavities. The Journal of organic chemistry 20061222
Encapsulation of a (H3O2)- unit in the aromatic core of a calix[6]arene closed by two Zn(II) ions at the small and large rims. Chemical communications (Cambridge, England) 20061001
Electrostatic layer-by-layer assembly of ultrathin films containing hexacyclen and p-sulfonatocalix[n]arene macrocycles. Journal of nanoscience and nanotechnology 20060601
Fluorescence studies of host-guest interaction of a dansyl amide labelled calix[6]arene. Journal of fluorescence 20060501
Optically pure calix[6]tris-ammoniums: syntheses and host-guest properties toward neutral guests. The Journal of organic chemistry 20051209
Fluorescence ratiometry of monomer/excimer emissions in a space-through PET system. The Journal of organic chemistry 20051111
Biomimetic zinc funnel complexes based on calix[6]N3ArO ligands: an acid-base switch for guest binding. Journal of the American Chemical Society 20051026
Inclusion of bisphenols by a self-assembled monolayer of thiolated calix[6]arene on a gold surface. Environmental science & technology 20050715
'Non-covalent synthesis' of a chiral host of calix[6]arene and enantiomeric discrimination. Magnetic resonance in chemistry : MRC 20050501
Selective single crystal complexation of L- or D-leucine by p-sulfonatocalix[6]arene. Chemical communications (Cambridge, England) 20050121
Complexation of phenolic guests by endo- and exo-hydrogen-bonded receptors. Organic & biomolecular chemistry 20030721
Properties