![1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one structure](/static/products/621/62161-06-2.png)
1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one
TL;DR: 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one (CAS 62161-06-2) is a chemical compound with molecular formula C20H30O7 and molecular weight 382.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one
Also Known As: 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one, 1-(1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16-hexadecahydrobenzo[3,4-a][18]annulen -18-yl)butan-1-one, 1-(2,3,5,6,8,9,11,12,14,15-decahydrobenzo[b][1,4,7,10,13,16]hexaoxacyclooctadecin-18-yl)butan-1-one
| Molecular Formula | C20H30O7 |
|---|---|
| Molecular Weight | 382.20 g/mol |
| LogP | 2.507 |
| Topological Polar Surface Area | 72.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.19916 |
| Heavy Atoms | 27 |
| Complexity | 547.13184 |
Chemical Identifiers
| CAS Number | 62161-06-2 |
|---|---|
| SMILES | CCCC(=O)C1=CC2=C(C=C1)OCCOCCOCCOCCOCCO2 |
Product Overview
1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one (CAS 62161-06-2), with molecular formula C20H30O7 and molecular weight 382.20 g/mol. IUPAC: 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one.
Chemical Property Profile of 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one
Property Insights of 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one
The XLogP value of 2.507 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one. The TPSA of 72.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one. Following Lipinski's Rule of Five, 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one 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-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one?
The CAS number of 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one is 62161-06-2.
What is the molecular formula of 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one?
The molecular formula of 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one is C20H30O7.
What is the molecular weight of 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one?
The molecular weight of 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one is 382.20 g/mol.
Where can I buy 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one?
You can request a quote for 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)butan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.