3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine
TL;DR: 3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine (CAS 83807-07-2) is a chemical compound with molecular formula C25H22O2 and molecular weight 354.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-ethyl-5-phenyl-2-prop-2-enoxybenzo[b][1]benzoxepine
Also Known As: DIBENZ(b,f)OXEPINE, 3-(ALLYLOXY)-10-ETHYL-11-PHENYL-, 3-(Allyloxy)-10-ethyl-11-phenyldibenz(b,f,)oxepine, 3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine, 3-allyloxy-10-ethyl-11-phenyldibenzo[b,f]oxepine, 6-ethyl-5-phenyl-2-prop-2-enoxybenzo[b][1]benzoxepine
| Molecular Formula | C25H22O2 |
|---|---|
| Molecular Weight | 354.16 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 354.162 |
| Heavy Atoms | 27 |
| Complexity | 530.0 |
Chemical Identifiers
| CAS Number | 83807-07-2 |
|---|---|
| SMILES | CCC1=C(C2=C(C=C(C=C2)OCC=C)OC3=CC=CC=C31)C4=CC=CC=C4 |
| InChIKey | FLHHKPBRUGMVKM-UHFFFAOYSA-N |
Product Overview
3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine (CAS 83807-07-2), with molecular formula C25H22O2 and molecular weight 354.16 g/mol. IUPAC: 6-ethyl-5-phenyl-2-prop-2-enoxybenzo[b][1]benzoxepine.
Chemical Property Profile of 3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine
Property Insights of 3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine
The XLogP value of 6.1 indicates that 3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine?
The CAS number of 3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine is 83807-07-2.
What is the molecular formula of 3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine?
The molecular formula of 3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine is C25H22O2.
What is the molecular weight of 3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine?
The molecular weight of 3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine is 354.16 g/mol.
Where can I buy 3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine?
You can request a quote for 3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine?
Yes, KEHONG BIO provides custom synthesis services for 3-(Allyloxy)-10-ethyl-11-phenyl dibenz(b,f)oxepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.