![2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one structure](/static/products/6144/61441-06-3.webp)
2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one
TL;DR: 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one (CAS 61441-06-3) is a chemical compound with molecular formula C16H14O4 and molecular weight 270.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dimethoxy-7H-benzo[d][2]benzoxepin-5-one
Also Known As: 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one, 2,3-dimethoxy-7H-benzo[d][2]benzoxepin-5-one
| Molecular Formula | C16H14O4 |
|---|---|
| Molecular Weight | 270.09 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 270.0892 |
| Heavy Atoms | 20 |
| Complexity | 356.0 |
Chemical Identifiers
| CAS Number | 61441-06-3 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C3=CC=CC=C3COC2=O)OC |
| InChIKey | FGADTCKUSPLWPZ-UHFFFAOYSA-N |
Product Overview
2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one (CAS 61441-06-3), with molecular formula C16H14O4 and molecular weight 270.09 g/mol. IUPAC: 2,3-dimethoxy-7H-benzo[d][2]benzoxepin-5-one.
Chemical Property Profile of 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one
Property Insights of 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one. With a topological polar surface area (TPSA) of 44.8 Ų, 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one has 0 hydrogen bond donor(s) and 4 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 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one?
The CAS number of 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one is 61441-06-3.
What is the molecular formula of 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one?
The molecular formula of 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one is C16H14O4.
What is the molecular weight of 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one?
The molecular weight of 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one is 270.09 g/mol.
Where can I buy 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one?
You can request a quote for 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dimethoxydibenzo[c,e]oxepin-5(7H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.