1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1)
TL;DR: 1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1) (CAS 60336-83-6) is a chemical compound with molecular formula C14H27NO6 and molecular weight 305.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
acetonitrile;1,4,7,10,13,16-hexaoxacyclooctadecane
Also Known As: 18-Crown-6, complex with acetonitrile, 1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1), acetonitrile; 1,4,7,10,13,16-hexaoxacyclooctadecane, Acetonitrile, compound with 1,4,7,10,13,16-hexaoxacyclooctadecane (1:1), Acetonitrile--1,4,7,10,13,16-hexaoxacyclooctadecane (1/1)
| Molecular Formula | C14H27NO6 |
|---|---|
| Molecular Weight | 305.18 g/mol |
| LogP | 0.63 |
| Topological Polar Surface Area | 79.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 305.18384 |
| Heavy Atoms | 21 |
| Complexity | 137.0 |
Chemical Identifiers
| CAS Number | 60336-83-6 |
|---|---|
| SMILES | CC#N.C1COCCOCCOCCOCCOCCO1 |
| InChIKey | NDINSWFIKBMLNU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1) (CAS 60336-83-6), with molecular formula C14H27NO6 and molecular weight 305.18 g/mol. IUPAC: acetonitrile;1,4,7,10,13,16-hexaoxacyclooctadecane.
Chemical Property Profile of 1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1)
Property Insights of 1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1)
The XLogP value of 0.63 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1). The TPSA of 79.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1). Following Lipinski's Rule of Five, 1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1) 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 1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1)?
The CAS number of 1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1) is 60336-83-6.
What is the molecular formula of 1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1)?
The molecular formula of 1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1) is C14H27NO6.
What is the molecular weight of 1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1)?
The molecular weight of 1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1) is 305.18 g/mol.
Where can I buy 1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1)?
You can request a quote for 1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 1,4,7,10,13,16-Hexaoxacyclooctadecane, compd. with acetonitrile (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.