![(11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate structure](/static/products/866/866156-25-4.png)
(11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate
TL;DR: (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate (CAS 866156-25-4) is a chemical compound with molecular formula C21H14O4 and molecular weight 330.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate
Also Known As: (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate, 11-oxo-6,11-dihydrodibenzo[b,e]oxepin-2-yl benzenecarboxylate, 2-oxo-9-oxatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,12,14-hexaen-5-yl benzoate, 2-oxo-9-oxatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,12,14-hexaen-5-ylbenzoate
| Molecular Formula | C21H14O4 |
|---|---|
| Molecular Weight | 330.09 g/mol |
| LogP | 4.0292 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 330.0892 |
| Heavy Atoms | 25 |
| Complexity | 960.6399 |
Chemical Identifiers
| CAS Number | 866156-25-4 |
|---|---|
| SMILES | C1C2=CC=CC=C2C(=O)C3=C(O1)C=CC(=C3)OC(=O)C4=CC=CC=C4 |
Product Overview
(11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate (CAS 866156-25-4), with molecular formula C21H14O4 and molecular weight 330.09 g/mol. IUPAC: (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate.
Chemical Property Profile of (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate
Property Insights of (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate
The XLogP value of 4.0292 indicates that (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate 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 (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate?
The CAS number of (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate is 866156-25-4.
What is the molecular formula of (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate?
The molecular formula of (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate is C21H14O4.
What is the molecular weight of (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate?
The molecular weight of (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate is 330.09 g/mol.
Where can I buy (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate?
You can request a quote for (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate?
Yes, KEHONG BIO provides custom synthesis services for (11-oxo-6H-benzo[c][1]benzoxepin-2-yl) benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.