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1,3-Dioctyloxy-calix[4]arene-crown-6
TL;DR: 1,3-Dioctyloxy-calix[4]arene-crown-6 (CAS 508178-51-6) is a chemical compound with molecular formula C54H74O8 and molecular weight 850.54 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
43,44-dioctoxy-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-Dioctyloxycalix[4]arene crown-6, 1,3-Dioctyloxy-calix[4]arene-crown-6, 1,3-DIOCTYLOXYCALIX[4!ARENECROWN-6, 97, 1,3 Di-n-octyloxy Calix(4)arene crown-6 stereoisomer, F1170-0238
| Molecular Formula | C54H74O8 |
|---|---|
| Molecular Weight | 850.54 g/mol |
| LogP | 11.6794 |
| Topological Polar Surface Area | 73.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 16 |
| Exact Mass | 850.5384 |
| Heavy Atoms | 62 |
| Complexity | 1653.6372 |
Chemical Identifiers
| CAS Number | 508178-51-6 |
|---|---|
| SMILES | CCCCCCCCOC1=C2CC3=C4C(=CC=C3)CC5=C(C(=CC=C5)CC6=CC=CC(=C6OCCOCCOCCOCCOCCO4)CC1=CC=C2)OCCCCCCCC |
Product Overview
1,3-Dioctyloxy-calix[4]arene-crown-6 (CAS 508178-51-6), with molecular formula C54H74O8 and molecular weight 850.54 g/mol. IUPAC: 43,44-dioctoxy-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.
Chemical Property Profile of 1,3-Dioctyloxy-calix[4]arene-crown-6
Property Insights of 1,3-Dioctyloxy-calix[4]arene-crown-6
The XLogP value of 11.6794 indicates that 1,3-Dioctyloxy-calix[4]arene-crown-6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dioctyloxy-calix[4]arene-crown-6. Following Lipinski's Rule of Five, 1,3-Dioctyloxy-calix[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
Frequently Asked Questions
What is the CAS number of 1,3-Dioctyloxy-calix[4]arene-crown-6?
The CAS number of 1,3-Dioctyloxy-calix[4]arene-crown-6 is 508178-51-6.
What is the molecular formula of 1,3-Dioctyloxy-calix[4]arene-crown-6?
The molecular formula of 1,3-Dioctyloxy-calix[4]arene-crown-6 is C54H74O8.
What is the molecular weight of 1,3-Dioctyloxy-calix[4]arene-crown-6?
The molecular weight of 1,3-Dioctyloxy-calix[4]arene-crown-6 is 850.54 g/mol.
Where can I buy 1,3-Dioctyloxy-calix[4]arene-crown-6?
You can request a quote for 1,3-Dioctyloxy-calix[4]arene-crown-6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dioctyloxy-calix[4]arene-crown-6?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioctyloxy-calix[4]arene-crown-6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.