p-Chloromethyl-methoxy-calix[4]arene

Base Information

• Chemical Name: p-Chloromethyl-methoxy-calix[4]arene
• CAS No.: 139934-98-8
• Molecular Formula: C₃₆H₃₆Cl₄O₄
• Molecular Weight: 674.491
• DSSTox Substance ID: DTXSID40446281
• Nikkaji Number: J1.924.125D
• Wikidata: Q82264893
• Mol file: 139934-98-8.mol

Synonyms:p-Chloromethyl-methoxy-calix[4]arene;139934-98-8;5,11,17,23-tetrakis(chloromethyl)-25,26,27,28-tetramethoxypentacyclo[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;DTXSID40446281;AKOS026705940;FT-0701604;F1170-0356;5,11,17,23-tetrakis(chloromethyl)-25,26,27,28-tetramethoxypentacyclo[19.3.1.1?,?.1?,??.1??,??]octacosa-1(25),3(28),4,6,9,11,13(27),15(26),16,18,21,23-dodecaene

Chemical Property of p-Chloromethyl-methoxy-calix[4]arene

Chemical Property:

• PSA: 36.92000
• LogP: 9.35280
• XLogP3: 9.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 674.133820
• Heavy Atom Count: 44
• Complexity: 682

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C2CC3=CC(=CC(=C3OC)CC4=C(C(=CC(=C4)CCl)CC5=C(C(=CC(=C5)CCl)CC1=CC(=C2)CCl)OC)OC)CCl

Technology Process of p-Chloromethyl-methoxy-calix[4]arene

There total 1 articles about p-Chloromethyl-methoxy-calix[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: 41.0%

25,26,27,28-tetramethoxycalix[4]arene (160497-00-7) → 5,11,17,23-tetramethoxy-25,26,27,28-tetrakis(chloromethyl)calix<4>arene (139934-98-8)

Guidance literature:

With hydrogenchloride; phosphoric acid; In 1,4-dioxane; acetic acid; at 100 ℃; for 8h;

DOI:10.1016/S0040-4020(01)88184-9

upstream raw materials:

25,26,27,28-tetramethoxycalix[4]arene