4-tert-Butylcalix[4]arene

Base Information

Chemical Name:4-tert-Butylcalix[4]arene
CAS No.:60705-62-6
Molecular Formula:C₄₄H₅₆O₄
Molecular Weight:648.926
Hs Code.:29072990
European Community (EC) Number:612-010-8
NSC Number:344251
DSSTox Substance ID:DTXSID70209528
Nikkaji Number:J338.071H
ChEMBL ID:CHEMBL4638477
Mol file:60705-62-6.mol

Synonyms:4-tert-Butylcalix[4]arene;60705-62-6;157432-87-6;5,11,17,23-Tetra-t-butyl-25,26,27,28-tetrahydroxycalix-4-arene;MFCD00066280;NSC344251;NSC 344251;5,11,17,23-Tetratert-butylpentacyclo(19.3.1.1(3,7).1(9,13).1(15,19))octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene-25,26,27,28-tetrol;5,11,17,23-tetratert-butylpentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3,5,7(28),9,11,13(27),15(26),16,18,21(25),22-dodecaene-25,26,27,28-tetrol;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,;4-t-butylcalix[4]arene;TBC4@130Degrees;tetratert-butyl[?]tetrol;Tetra-tert-butyl(tetrahydroxy)calix[4]arene;p-tert-Butylcalix(4)arene;SCHEMBL9910710;CHEMBL4638477;DTXSID70209528;4-tert-Butylcalix[4]arene, 95%;BCP20510;CS-M1853;AKOS000278329;C44-H56-O4;NSC-344251;AS-19166;SY005562;B1809;FT-0619502;F11811;A868906;A926887;EN300-18464608;J-700381;Q-101992;F1170-0179;Z275313776;5,11,17,23-Tetra-t-butyl-25,26,27,28-tetrahydroxycalix-4-arene stereoisomer;15,35,55,75-tetra-tert-Butyl-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-12,32,52,72-tetraol;5,11,17,23-tetra-tert-butylpentacyclo[19.3.1.1?,?.1?,??.1??,??]octacosa-1(25),3(28),4,6,9,11,13(27),15(26),16,18,21,23-dodecaene-25,26,27,28-tetrol;5,11,17,23-tetra-tert-butylpentacyclo[19.3.1.1^{3,7}.1^{9,13}.1^{15,19}]octacosa-1(25),3,5,7(28),9,11,13(27),15(26),16,18,21,23-dodecaene-25,26,27,28-tetrol;5,11,17,23-tetratert-butylpentacyclo[19.3.1.1^{3,7.1^{9,13.1^{15,19]octacosa-1(24),3,5,7(28),9,11,13(27),15(26),16,18,21(25),22-dodecaene-25,26,27,28-tetrol;5,11,17,23-Tetratert-butylpentacyclo[19.3.1.1~3,7~.1~9,13~.1~15,19~]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene-25,26,27,28-tetrol;Oc1c2Cc3cc(cc(Cc4cc(cc(Cc5cc(cc(Cc1cc(c2)C(C)(C)C)c5O)C(C)(C)C)c4O)C(C)(C)C)c3O)C(C)(C)C;Pentacyclo[19.3.1.1(3,7).1(9,13).1(15,19)]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-25,26,27,28-tetrol, 5,11,17,23-tetrakis(1,1-dimethylethyl);Pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-25,26,27,28-tetrol, 5,11,17,23-tetrakis(1,1-dimethylethyl)-

Suppliers and Price of 4-tert-Butylcalix[4]arene

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
4-tert-Butylcalix[4]arene
100g
$ 880.00

TRC
4-tert-Butylcalix[4]arene
25g
$ 250.00

TCI Chemical
4-tert-Butylcalix[4]arene >98.0%(HPLC)
1g
$ 33.00

TCI Chemical
4-tert-Butylcalix[4]arene >98.0%(HPLC)
25g
$ 280.00

TCI Chemical
4-tert-Butylcalix[4]arene >98.0%(HPLC)
5g
$ 88.00

SynQuest Laboratories
4-tert-Butylcalix[4]arene
25 g
$ 424.00

SynQuest Laboratories
4-tert-Butylcalix[4]arene
5 g
$ 152.00

Sigma-Aldrich
4-tert-Butylcalix[4]arene 95%
5g
$ 137.00

Sigma-Aldrich
p-tert-Butylcalix[4]arene for synthesis
1 g
$ 128.57

Sigma-Aldrich
4-tert-Butylcalix[4]arene 95%
25g
$ 496.00

Total 91 raw suppliers

Chemical Property of 4-tert-Butylcalix[4]arene

Chemical Property:

Appearance/Colour:White to light beige crystalline powder or flakes
Vapor Pressure:2.73E-19mmHg at 25°C
Melting Point:≥300 °C(lit.)
Refractive Index:1.582
Boiling Point:683.146 °C at 760 mmHg
PKA:9.53±0.20(Predicted)
Flash Point:252.589 °C
PSA：80.92000
Density:1.095 g/cm³
LogP:10.37560
Storage Temp.:Store below +30°C.
Water Solubility.:Soluble in chloroform, benzene, toluene. Insoluble in water.
XLogP3:13
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:648.41786026
Heavy Atom Count:48
Complexity:840

Purity/Quality:

99% ^*data from raw suppliers

4-tert-Butylcalix[4]arene ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Statements: 36/37/38
Safety Statements: 22-24/25

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)C1=CC2=C(C(=C1)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)C(C)(C)C)C2)O)C(C)(C)C)C(C)(C)C)O
Uses It is used as a starting material for further derivatization, including halogenation, acylation, and diazo coupling.

Technology Process of 4-tert-Butylcalix[4]arene

There total 77 articles about 4-tert-Butylcalix[4]arene which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 65.0%

: 50-00-0,30525-89-4,61233-19-0
formaldehyd

: 98-54-4
para-tert-butylphenol

: 24085-65-2
4,4'‐oxybis(tert‐butylbenzene)

: 157432-87-6,288302-11-4,288302-12-5,60705-62-6
5,11,17,23-tetra-t-butyl-25,26,27,28-tetrahydroxycalix-4-arene

: 189832-67-5,78092-53-2
5,11,17,23,29,35-hexakis(tert-butyl)-37,38,39,40,41-hexakis(hydroxy)calix[6]arene

: 68971-82-4,106750-70-3,78092-52-1
5,11,17,23,29,35,41,47-octakis(tert-butyl)-49,50,51,52,53,54,55,56-octakis(hydroxy)calix[8]arene

: 81475-22-1
p-tert-Butylcalix[5]arene

: 84161-29-5
5,11,17,23,29,35,41-heptakis(1,1-dimethylethyl)-43,44,45,46,47,48,49-heptahydroxy calix[7]arene

Guidance literature:: With sodium hydroxide; In 5,5-dimethyl-1,3-cyclohexadiene; for 5.5h; Dean-Stark; Inert atmosphere; Reflux;
DOI:10.15227/orgsyn.068.0243