![2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one structure](/static/products/974/97455-13-5.png)
2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one
TL;DR: 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one (CAS 97455-13-5) is a chemical compound with molecular formula C9H14O2 and molecular weight 154.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,4,4-tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one
Also Known As: 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one, 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one #, 6-Oxabicyclo[3.1.0]hexan-3-one, 2,2,4,4-tetramethyl-
| Molecular Formula | C9H14O2 |
|---|---|
| Molecular Weight | 154.10 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 29.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 154.09938 |
| Heavy Atoms | 11 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 97455-13-5 |
|---|---|
| SMILES | CC1(C2C(O2)C(C1=O)(C)C)C |
| InChIKey | MQFYOLNQSLSYAP-UHFFFAOYSA-N |
Product Overview
2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one (CAS 97455-13-5), with molecular formula C9H14O2 and molecular weight 154.10 g/mol. IUPAC: 2,2,4,4-tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one.
Chemical Property Profile of 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one
Property Insights of 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one. With a topological polar surface area (TPSA) of 29.6 Ų, 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-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 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one?
The CAS number of 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one is 97455-13-5.
What is the molecular formula of 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one?
The molecular formula of 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one is C9H14O2.
What is the molecular weight of 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one?
The molecular weight of 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one is 154.10 g/mol.
Where can I buy 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one?
You can request a quote for 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2,2,4,4-Tetramethyl-6-oxabicyclo[3.1.0]hexan-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.