1,5-Dihydro-3-methoxy-2,4-benzodioxepin
TL;DR: 1,5-Dihydro-3-methoxy-2,4-benzodioxepin (CAS 67461-24-9) is a chemical compound with molecular formula C10H12O3 and molecular weight 180.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxy-1,5-dihydro-2,4-benzodioxepine
Also Known As: adenosine, 1,5-DIHYDRO-3-METHOXY-2,4-BENZODIOXEPIN, 3-methoxy-1,5-dihydro-2,4-benzodioxepine, LABOTEST-BB LT00112419, 3-methoxy-1,5-dihydro-3H-2,4-benzodioxepine
| Molecular Formula | C10H12O3 |
|---|---|
| Molecular Weight | 180.08 g/mol |
| LogP | 1.6634 |
| Topological Polar Surface Area | 27.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.07864 |
| Heavy Atoms | 13 |
| Complexity | 258.25327 |
Chemical Identifiers
| CAS Number | 67461-24-9 |
|---|---|
| SMILES | COC1OCC2=CC=CC=C2CO1 |
Product Overview
1,5-Dihydro-3-methoxy-2,4-benzodioxepin (CAS 67461-24-9), with molecular formula C10H12O3 and molecular weight 180.08 g/mol. IUPAC: 3-methoxy-1,5-dihydro-2,4-benzodioxepine.
Chemical Property Profile of 1,5-Dihydro-3-methoxy-2,4-benzodioxepin
Property Insights of 1,5-Dihydro-3-methoxy-2,4-benzodioxepin
The XLogP value of 1.6634 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,5-Dihydro-3-methoxy-2,4-benzodioxepin. With a topological polar surface area (TPSA) of 27.69 Ų, 1,5-Dihydro-3-methoxy-2,4-benzodioxepin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-Dihydro-3-methoxy-2,4-benzodioxepin has 0 hydrogen bond donor(s) and 3 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 1,5-Dihydro-3-methoxy-2,4-benzodioxepin?
The CAS number of 1,5-Dihydro-3-methoxy-2,4-benzodioxepin is 67461-24-9.
What is the molecular formula of 1,5-Dihydro-3-methoxy-2,4-benzodioxepin?
The molecular formula of 1,5-Dihydro-3-methoxy-2,4-benzodioxepin is C10H12O3.
What is the molecular weight of 1,5-Dihydro-3-methoxy-2,4-benzodioxepin?
The molecular weight of 1,5-Dihydro-3-methoxy-2,4-benzodioxepin is 180.08 g/mol.
Where can I buy 1,5-Dihydro-3-methoxy-2,4-benzodioxepin?
You can request a quote for 1,5-Dihydro-3-methoxy-2,4-benzodioxepin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Dihydro-3-methoxy-2,4-benzodioxepin?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Dihydro-3-methoxy-2,4-benzodioxepin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.