3-Oxatricyclo(3.1.0.02,6)hexan-4-one
TL;DR: 3-Oxatricyclo(3.1.0.02,6)hexan-4-one (CAS 19192-82-6) is a chemical compound with molecular formula C5H4O2 and molecular weight 96.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-oxatricyclo[3.1.0.02,6]hexan-4-one
Also Known As: 3-Oxatricyclo(3.1.0.02,6)hexan-4-one, KAYMRZOTMLPTHA-UHFFFAOYSA-, 3-Oxatricyclo[3.1.0.0~2,6~]hexan-4-one, InChI=1/C5H4O2/c6-5-3-1-2(3)4(1)7-5/h1-4H
| Molecular Formula | C5H4O2 |
|---|---|
| Molecular Weight | 96.02 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 96.021126 |
| Heavy Atoms | 7 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 19192-82-6 |
|---|---|
| SMILES | C12C3C1C(=O)OC23 |
| InChIKey | KAYMRZOTMLPTHA-UHFFFAOYSA-N |
Product Overview
3-Oxatricyclo(3.1.0.02,6)hexan-4-one (CAS 19192-82-6), with molecular formula C5H4O2 and molecular weight 96.02 g/mol. IUPAC: 3-oxatricyclo[3.1.0.02,6]hexan-4-one.
Chemical Property Profile of 3-Oxatricyclo(3.1.0.02,6)hexan-4-one
Property Insights of 3-Oxatricyclo(3.1.0.02,6)hexan-4-one
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Oxatricyclo(3.1.0.02,6)hexan-4-one. With a topological polar surface area (TPSA) of 26.3 Ų, 3-Oxatricyclo(3.1.0.02,6)hexan-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Oxatricyclo(3.1.0.02,6)hexan-4-one 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 3-Oxatricyclo(3.1.0.02,6)hexan-4-one?
The CAS number of 3-Oxatricyclo(3.1.0.02,6)hexan-4-one is 19192-82-6.
What is the molecular formula of 3-Oxatricyclo(3.1.0.02,6)hexan-4-one?
The molecular formula of 3-Oxatricyclo(3.1.0.02,6)hexan-4-one is C5H4O2.
What is the molecular weight of 3-Oxatricyclo(3.1.0.02,6)hexan-4-one?
The molecular weight of 3-Oxatricyclo(3.1.0.02,6)hexan-4-one is 96.02 g/mol.
Where can I buy 3-Oxatricyclo(3.1.0.02,6)hexan-4-one?
You can request a quote for 3-Oxatricyclo(3.1.0.02,6)hexan-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Oxatricyclo(3.1.0.02,6)hexan-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Oxatricyclo(3.1.0.02,6)hexan-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.