8-Methyldibenzo(b,f)(1,4)oxazepine
TL;DR: 8-Methyldibenzo(b,f)(1,4)oxazepine (CAS 55113-22-9) is a chemical compound with molecular formula C14H11NO and molecular weight 209.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylbenzo[b][1,4]benzoxazepine
Also Known As: 8-Methyldibenzo(b,f)(1,4)oxazepine, 3-methylbenzo[b][1,4]benzoxazepine, 8-Methyldibenzo[b,f][1,4]oxazepine, 8-Methyl-dibenz
| Molecular Formula | C14H11NO |
|---|---|
| Molecular Weight | 209.08 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 21.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 209.08406 |
| Heavy Atoms | 16 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 55113-22-9 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)OC3=CC=CC=C3C=N2 |
| InChIKey | KQLZLXUHKFVMTF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
8-Methyldibenzo(b,f)(1,4)oxazepine (CAS 55113-22-9), with molecular formula C14H11NO and molecular weight 209.08 g/mol. IUPAC: 3-methylbenzo[b][1,4]benzoxazepine.
Chemical Property Profile of 8-Methyldibenzo(b,f)(1,4)oxazepine
Property Insights of 8-Methyldibenzo(b,f)(1,4)oxazepine
The XLogP value of 3.0 indicates that 8-Methyldibenzo(b,f)(1,4)oxazepine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.6 Ų, 8-Methyldibenzo(b,f)(1,4)oxazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Methyldibenzo(b,f)(1,4)oxazepine has 0 hydrogen bond donor(s) and 2 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 8-Methyldibenzo(b,f)(1,4)oxazepine?
The CAS number of 8-Methyldibenzo(b,f)(1,4)oxazepine is 55113-22-9.
What is the molecular formula of 8-Methyldibenzo(b,f)(1,4)oxazepine?
The molecular formula of 8-Methyldibenzo(b,f)(1,4)oxazepine is C14H11NO.
What is the molecular weight of 8-Methyldibenzo(b,f)(1,4)oxazepine?
The molecular weight of 8-Methyldibenzo(b,f)(1,4)oxazepine is 209.08 g/mol.
Where can I buy 8-Methyldibenzo(b,f)(1,4)oxazepine?
You can request a quote for 8-Methyldibenzo(b,f)(1,4)oxazepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Methyldibenzo(b,f)(1,4)oxazepine?
Yes, KEHONG BIO provides custom synthesis services for 8-Methyldibenzo(b,f)(1,4)oxazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.