![7-Oxabicyclo[4.1.0]heptan-1-yl acetate structure](/static/products/141/14161-46-7.png)
7-Oxabicyclo[4.1.0]heptan-1-yl acetate
TL;DR: 7-Oxabicyclo[4.1.0]heptan-1-yl acetate (CAS 14161-46-7) is a chemical compound with molecular formula C8H12O3 and molecular weight 156.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-oxabicyclo[4.1.0]heptan-1-yl acetate
Also Known As: 1-Acetoxy-1,2-epoxycyclohexane, 7-oxabicyclo[4.1.0]heptan-1-yl acetate, 7-Oxabicyclo[4.1.0]hept-1-yl acetate, 7-Oxabicyclo[4.1.0]heptan-1-ol, acetate, 1-Acetoxy-7-oxabicyclo[4.1.0]heptane
| Molecular Formula | C8H12O3 |
|---|---|
| Molecular Weight | 156.08 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 156.07864 |
| Heavy Atoms | 11 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 14161-46-7 |
|---|---|
| SMILES | CC(=O)OC12CCCCC1O2 |
| InChIKey | ZWIHBBOOXYYXNF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-Oxabicyclo[4.1.0]heptan-1-yl acetate (CAS 14161-46-7), with molecular formula C8H12O3 and molecular weight 156.08 g/mol. IUPAC: 7-oxabicyclo[4.1.0]heptan-1-yl acetate.
Chemical Property Profile of 7-Oxabicyclo[4.1.0]heptan-1-yl acetate
Property Insights of 7-Oxabicyclo[4.1.0]heptan-1-yl acetate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Oxabicyclo[4.1.0]heptan-1-yl acetate. With a topological polar surface area (TPSA) of 38.8 Ų, 7-Oxabicyclo[4.1.0]heptan-1-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Oxabicyclo[4.1.0]heptan-1-yl acetate has 0 hydrogen bond donor(s) and 3 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 7-Oxabicyclo[4.1.0]heptan-1-yl acetate?
The CAS number of 7-Oxabicyclo[4.1.0]heptan-1-yl acetate is 14161-46-7.
What is the molecular formula of 7-Oxabicyclo[4.1.0]heptan-1-yl acetate?
The molecular formula of 7-Oxabicyclo[4.1.0]heptan-1-yl acetate is C8H12O3.
What is the molecular weight of 7-Oxabicyclo[4.1.0]heptan-1-yl acetate?
The molecular weight of 7-Oxabicyclo[4.1.0]heptan-1-yl acetate is 156.08 g/mol.
Where can I buy 7-Oxabicyclo[4.1.0]heptan-1-yl acetate?
You can request a quote for 7-Oxabicyclo[4.1.0]heptan-1-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Oxabicyclo[4.1.0]heptan-1-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 7-Oxabicyclo[4.1.0]heptan-1-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.