Dicyclohexyl 21-crown-7
TL;DR: Dicyclohexyl 21-crown-7 (CAS 17455-21-9) is a chemical compound with molecular formula C26H48O7 and molecular weight 472.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dicyclohexyl-1,4,7,10,13,16,19-heptaoxacyclohenicosane
Also Known As: Dicyclohexyl 21-crown-7, DICYCLOHEXANO-21-CROWN-7, Dicyclohexyl-21-Krone-7, BIS(CYCLOHEXANO)-21-CROWN-7, 2,2-dicyclohexyl-1,4,7,10,13,16,19-heptaoxacyclohenicosane
| Molecular Formula | C26H48O7 |
|---|---|
| Molecular Weight | 472.34 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 472.34 |
| Heavy Atoms | 33 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 17455-21-9 |
|---|---|
| SMILES | C1CCC(CC1)C2(COCCOCCOCCOCCOCCOCCO2)C3CCCCC3 |
| InChIKey | IOWILYDIQORSRC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dicyclohexyl 21-crown-7 (CAS 17455-21-9), with molecular formula C26H48O7 and molecular weight 472.34 g/mol. IUPAC: 2,2-dicyclohexyl-1,4,7,10,13,16,19-heptaoxacyclohenicosane.
Chemical Property Profile of Dicyclohexyl 21-crown-7
Property Insights of Dicyclohexyl 21-crown-7
The XLogP value of 3.6 indicates that Dicyclohexyl 21-crown-7 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Dicyclohexyl 21-crown-7. Following Lipinski's Rule of Five, Dicyclohexyl 21-crown-7 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dicyclohexyl 21-crown-7?
The CAS number of Dicyclohexyl 21-crown-7 is 17455-21-9.
What is the molecular formula of Dicyclohexyl 21-crown-7?
The molecular formula of Dicyclohexyl 21-crown-7 is C26H48O7.
What is the molecular weight of Dicyclohexyl 21-crown-7?
The molecular weight of Dicyclohexyl 21-crown-7 is 472.34 g/mol.
Where can I buy Dicyclohexyl 21-crown-7?
You can request a quote for Dicyclohexyl 21-crown-7 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dicyclohexyl 21-crown-7?
Yes, KEHONG BIO provides custom synthesis services for Dicyclohexyl 21-crown-7 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.