3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol
TL;DR: 3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol (CAS 66036-65-5) is a chemical compound with molecular formula C8H14O2 and molecular weight 142.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-7-oxabicyclo[4.1.0]heptan-2-ol
Also Known As: 5,5-dimethyl-2,3-epoxycyclohexanol, 3,3-dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol, 4,4-dimethyl-7-oxabicyclo[4.1.0]heptan-2-ol
| Molecular Formula | C8H14O2 |
|---|---|
| Molecular Weight | 142.10 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 142.09938 |
| Heavy Atoms | 10 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 66036-65-5 |
|---|---|
| SMILES | CC1(CC(C2C(C1)O2)O)C |
| InChIKey | OFYFZVMSDXIGBY-UHFFFAOYSA-N |
Product Overview
3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol (CAS 66036-65-5), with molecular formula C8H14O2 and molecular weight 142.10 g/mol. IUPAC: 4,4-dimethyl-7-oxabicyclo[4.1.0]heptan-2-ol.
Chemical Property Profile of 3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol
Property Insights of 3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol. With a topological polar surface area (TPSA) of 32.8 Ų, 3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol has 1 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 3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol?
The CAS number of 3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol is 66036-65-5.
What is the molecular formula of 3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol?
The molecular formula of 3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol is C8H14O2.
What is the molecular weight of 3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol?
The molecular weight of 3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol is 142.10 g/mol.
Where can I buy 3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol?
You can request a quote for 3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dimethyl-7-oxabicyclo[4.1.0]heptan-5-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.