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1,3-Diisopropoxycalix[4]arene crown-6 structure
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1,3-Diisopropoxycalix[4]arene crown-6

TL;DR: 1,3-Diisopropoxycalix[4]arene crown-6 (CAS 161282-96-8) is a chemical compound with molecular formula C44H54O8 and molecular weight 710.3819 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

43,44-di(propan-2-yloxy)-3,6,9,12,15,18-hexaoxahexacyclo[18.15.7.126,30.137,41.02,32.019,24]tetratetraconta-1(35),2(32),19(24),20,22,26,28,30(44),33,37(43),38,40-dodecaene

Also Known As: 1,3-Diisopropoxycalix[4]arene crown-6, 1,3-Diisopropoxycalix[4]arenecrown-6, 1,3-diisopropoxycalix[4]arene-crown-6, 1,3-Diisopropoxyy-calix[4]arene-crown-6, 1,3-Diisopropoxycalix[4]Arenecrown-6 97%

CAS Number
161282-96-8
Molecular Formula
C44H54O8
Molecular Weight
710.3819 g/mol
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Technical Specifications

Molecular FormulaC44H54O8
Molecular Weight710.3819 g/mol
XLogP8.4
Topological Polar Surface Area (TPSA)73.8 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors8
Rotatable Bonds4
Exact Mass710.3819 Da
Heavy Atoms52
Complexity858.0
SMILESCC(C)OC1=C2CC3=C4C(=CC=C3)CC5=C(C(=CC=C5)CC6=CC=CC(=C6OCCOCCOCCOCCOCCO4)CC1=CC=C2)OC(C)C
InChIKeyRKXRMMYNTOHWDA-UHFFFAOYSA-N

Chemical Property Profile of 1,3-Diisopropoxycalix[4]arene crown-6

XLogP
8.4
TPSA (Topological Polar Surface Area)
73.8
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
8
Rotatable Bonds
4
Heavy Atoms
52
Complexity
858.0
Exact Mass
710.3819
Monoisotopic Mass
710.3819
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 1,3-Diisopropoxycalix[4]arene crown-6

The XLogP value of 8.4 indicates that 1,3-Diisopropoxycalix[4]arene crown-6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Diisopropoxycalix[4]arene crown-6. Following Lipinski's Rule of Five, 1,3-Diisopropoxycalix[4]arene crown-6 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 1,3-Diisopropoxycalix[4]arene crown-6?

The CAS number of 1,3-Diisopropoxycalix[4]arene crown-6 is 161282-96-8.

What is the molecular formula of 1,3-Diisopropoxycalix[4]arene crown-6?

The molecular formula of 1,3-Diisopropoxycalix[4]arene crown-6 is C44H54O8.

What is the molecular weight of 1,3-Diisopropoxycalix[4]arene crown-6?

The molecular weight of 1,3-Diisopropoxycalix[4]arene crown-6 is 710.3819 g/mol.

Where can I buy 1,3-Diisopropoxycalix[4]arene crown-6?

You can request a quote for 1,3-Diisopropoxycalix[4]arene crown-6 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1,3-Diisopropoxycalix[4]arene crown-6?

Yes, CoreyChem provides custom synthesis services for 1,3-Diisopropoxycalix[4]arene crown-6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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