![Calix[4]-bis-1,2-benzo-crown-6 structure](/static/products/1577/157769-17-0.webp)
Calix[4]-bis-1,2-benzo-crown-6
TL;DR: Calix[4]-bis-1,2-benzo-crown-6 (CAS 157769-17-0) is a chemical compound with molecular formula C56H60O12 and molecular weight 924.40845 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,6,9,16,19,22,36,39,42,49,52,55-dodecaoxanonacyclo[32.32.1.124,57.02,63.010,15.023,28.030,35.043,48.056,61]octahexaconta-1(66),2(63),10,12,14,23,25,27,30,32,34,43,45,47,56(61),57,59,64-octadecaene
Also Known As: Calix[4]-bis-1,2-benzo-crown-6, PBCMLIX[4]-BIS-1,2-BENZO-CROWN-6, 3,6,9,16,19,22,36,39,42,49,52,55-Dodecaoxanonacyclo[32.32.1.124,57.02,63.010,15.023,28.030,35.043,48.056,61]octahexaconta-1(66),2(63),10,12,14,23,25,27,30,32,34,43,45,47,56(61),57,59,64-octadecaene, C56H60O12
Technical Specifications
| Molecular Formula | C56H60O12 |
| Molecular Weight | 924.40845 g/mol |
| XLogP | 9.0 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 0 |
| Exact Mass | 924.40845 Da |
| Heavy Atoms | 68 |
| Complexity | 1130.0 |
| SMILES | C1COC2=CC=CC=C2OCCOCCOC3=C4CC5=CC=CC6=C5OCCOCCOC7=CC=CC=C7OCCOCCOC8=C(CC9=CC=CC(=C9OCCO1)C6)C=CC=C8CC3=CC=C4 |
| InChIKey | HQBHRJNTROESEU-UHFFFAOYSA-N |
Chemical Property Profile of Calix[4]-bis-1,2-benzo-crown-6
Property Insights of Calix[4]-bis-1,2-benzo-crown-6
The XLogP value of 9.0 indicates that Calix[4]-bis-1,2-benzo-crown-6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Calix[4]-bis-1,2-benzo-crown-6. Following Lipinski's Rule of Five, Calix[4]-bis-1,2-benzo-crown-6 has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Calix[4]-bis-1,2-benzo-crown-6?
The CAS number of Calix[4]-bis-1,2-benzo-crown-6 is 157769-17-0.
What is the molecular formula of Calix[4]-bis-1,2-benzo-crown-6?
The molecular formula of Calix[4]-bis-1,2-benzo-crown-6 is C56H60O12.
What is the molecular weight of Calix[4]-bis-1,2-benzo-crown-6?
The molecular weight of Calix[4]-bis-1,2-benzo-crown-6 is 924.40845 g/mol.
Where can I buy Calix[4]-bis-1,2-benzo-crown-6?
You can request a quote for Calix[4]-bis-1,2-benzo-crown-6 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Calix[4]-bis-1,2-benzo-crown-6?
Yes, CoreyChem provides custom synthesis services for Calix[4]-bis-1,2-benzo-crown-6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.