6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl-
TL;DR: 6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl- (CAS 2437-97-0) is a chemical compound with molecular formula C10H16O and molecular weight 152.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,7,7-trimethyl-6-oxabicyclo[3.2.1]oct-3-ene
Also Known As: Pinol, xi-Pinol, 4,7,7-trimethyl-6-oxabicyclo[3.2.1]oct-3-ene, 6,8-Epoxy-1-menthene, p-Menth-1-ene,8-epoxy
| Molecular Formula | C10H16O |
|---|---|
| Molecular Weight | 152.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 152.12012 |
| Heavy Atoms | 11 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 2437-97-0 |
|---|---|
| SMILES | CC1=CCC2CC1OC2(C)C |
| InChIKey | SKBXVAOMEVOTGJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl- (CAS 2437-97-0), with molecular formula C10H16O and molecular weight 152.12 g/mol. IUPAC: 4,7,7-trimethyl-6-oxabicyclo[3.2.1]oct-3-ene.
Chemical Property Profile of 6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl-
Property Insights of 6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl-. With a topological polar surface area (TPSA) of 9.2 Ų, 6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl- 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 6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl-?
The CAS number of 6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl- is 2437-97-0.
What is the molecular formula of 6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl-?
The molecular formula of 6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl- is C10H16O.
What is the molecular weight of 6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl-?
The molecular weight of 6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl- is 152.12 g/mol.
Where can I buy 6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl-?
You can request a quote for 6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.