![11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)- structure](/static/products/6709/67097-21-6.webp)
11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)-
TL;DR: 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)- (CAS 67097-21-6) is a chemical compound with molecular formula C20H22O5 and molecular weight 342.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butan-2-yl-9-hydroxy-3-methoxy-4,7-dimethylbenzo[b][1,4]benzodioxepin-6-one
Also Known As: 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)-, 1-butan-2-yl-9-hydroxy-3-methoxy-4,7-dimethylbenzo[b][1,4]benzodioxepin-6-one, 3-Hydroxy-8-methoxy-1,9-dimethyl-6- -11H-dibenzo[b,e][1,4]dioxepin-11-one, 3-Hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)-11H-dibenzo[b,e][1,4]dioxepin-11-one, 6-Sec-butyl-3-hydroxy-8-methoxy-1,9-dimethyl-11H-dibenzo[b,E][1,4]dioxepin-11-one
| Molecular Formula | C20H22O5 |
|---|---|
| Molecular Weight | 342.15 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 342.14673 |
| Heavy Atoms | 25 |
| Complexity | 481.0 |
Chemical Identifiers
| CAS Number | 67097-21-6 |
|---|---|
| SMILES | CCC(C)C1=CC(=C(C2=C1OC3=C(C(=CC(=C3)O)C)C(=O)O2)C)OC |
| InChIKey | PKUGPVDZCUYGKK-UHFFFAOYSA-N |
Product Overview
11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)- (CAS 67097-21-6), with molecular formula C20H22O5 and molecular weight 342.15 g/mol. IUPAC: 1-butan-2-yl-9-hydroxy-3-methoxy-4,7-dimethylbenzo[b][1,4]benzodioxepin-6-one.
Chemical Property Profile of 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)-
Property Insights of 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)-
The XLogP value of 5.0 indicates that 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)-. Following Lipinski's Rule of Five, 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)- has 1 hydrogen bond donor(s) and 5 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 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)-?
The CAS number of 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)- is 67097-21-6.
What is the molecular formula of 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)-?
The molecular formula of 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)- is C20H22O5.
What is the molecular weight of 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)-?
The molecular weight of 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)- is 342.15 g/mol.
Where can I buy 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)-?
You can request a quote for 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)-?
Yes, KEHONG BIO provides custom synthesis services for 11H-Dibenzo[b,e][1,4]dioxepin-11-one, 3-hydroxy-8-methoxy-1,9-dimethyl-6-(1-methylpropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.