噁庚因
TL;DR: 噁庚因 (CAS 291-70-3) is a chemical compound with molecular formula C6H6O and molecular weight 94.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
噁庚因
oxepine
Also Known As: Oxepin, oxepine, Oxacycloheptatriene, Oxepins, Oxepene
| Molecular Formula | C6H6O |
|---|---|
| Molecular Weight | 94.04 g/mol |
| LogP | 1.6002 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 94.04186 |
| Heavy Atoms | 7 |
| Complexity | 106.14171 |
Chemical Identifiers
| CAS Number | 291-70-3 |
|---|---|
| SMILES | C1=CC=COC=C1 |
Product Overview
噁庚因 (CAS 291-70-3), with molecular formula C6H6O and molecular weight 94.04 g/mol. IUPAC: oxepine.
Chemical Property Profile of 噁庚因
Property Insights of 噁庚因
The XLogP value of 1.6002 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 噁庚因. With a topological polar surface area (TPSA) of 9.23 Ų, 噁庚因 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 噁庚因 has 0 hydrogen bond donor(s) and 1 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 噁庚因?
The CAS number of 噁庚因 is 291-70-3.
What is the molecular formula of 噁庚因?
The molecular formula of 噁庚因 is C6H6O.
What is the molecular weight of 噁庚因?
The molecular weight of 噁庚因 is 94.04 g/mol.
Where can I buy 噁庚因?
You can request a quote for 噁庚因 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 噁庚因?
Yes, KEHONG BIO provides custom synthesis services for 噁庚因 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.