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(Bicyclo[2.2.2]oct-2-en-1-yl)methanol
TL;DR: (Bicyclo[2.2.2]oct-2-en-1-yl)methanol (CAS 2516-16-7) is a chemical compound with molecular formula C9H14O and molecular weight 138.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bicyclo[2.2.2]oct-2-enylmethanol
Also Known As: 4-bicyclo[2.2.2]oct-2-enylmethanol, (Bicyclo[2.2.2]oct-2-en-1-yl)methanol
| Molecular Formula | C9H14O |
|---|---|
| Molecular Weight | 138.10 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 138.10446 |
| Heavy Atoms | 10 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 2516-16-7 |
|---|---|
| SMILES | C1CC2(CCC1C=C2)CO |
| InChIKey | DYHBRWNHRJOPPA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(Bicyclo[2.2.2]oct-2-en-1-yl)methanol (CAS 2516-16-7), with molecular formula C9H14O and molecular weight 138.10 g/mol. IUPAC: 1-bicyclo[2.2.2]oct-2-enylmethanol.
Chemical Property Profile of (Bicyclo[2.2.2]oct-2-en-1-yl)methanol
Property Insights of (Bicyclo[2.2.2]oct-2-en-1-yl)methanol
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Bicyclo[2.2.2]oct-2-en-1-yl)methanol. With a topological polar surface area (TPSA) of 20.2 Ų, (Bicyclo[2.2.2]oct-2-en-1-yl)methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Bicyclo[2.2.2]oct-2-en-1-yl)methanol has 1 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 (Bicyclo[2.2.2]oct-2-en-1-yl)methanol?
The CAS number of (Bicyclo[2.2.2]oct-2-en-1-yl)methanol is 2516-16-7.
What is the molecular formula of (Bicyclo[2.2.2]oct-2-en-1-yl)methanol?
The molecular formula of (Bicyclo[2.2.2]oct-2-en-1-yl)methanol is C9H14O.
What is the molecular weight of (Bicyclo[2.2.2]oct-2-en-1-yl)methanol?
The molecular weight of (Bicyclo[2.2.2]oct-2-en-1-yl)methanol is 138.10 g/mol.
Where can I buy (Bicyclo[2.2.2]oct-2-en-1-yl)methanol?
You can request a quote for (Bicyclo[2.2.2]oct-2-en-1-yl)methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Bicyclo[2.2.2]oct-2-en-1-yl)methanol?
Yes, KEHONG BIO provides custom synthesis services for (Bicyclo[2.2.2]oct-2-en-1-yl)methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.