![Methyl bicyclo[2.1.1]hexane-5-carboxylate structure](/static/products/5651/565184-50-1.webp)
Methyl bicyclo[2.1.1]hexane-5-carboxylate
TL;DR: Methyl bicyclo[2.1.1]hexane-5-carboxylate (CAS 565184-50-1) is a chemical compound with molecular formula C8H12O2 and molecular weight 140.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl bicyclo[2.1.1]hexane-5-carboxylate
Also Known As: methyl bicyclo[2.1.1]hexane-5-carboxylate, methyl bicyclo(2.1.1)hexane-5-carboxylate, methyl bicyclo[2,1,1 ]hexane-5-carboxylate, Bicyclo[2.1.1]hexane-5-carboxylicacid,methylester, 2,2':5',2''-Terthiophene,5,5''-dibromo-3',4'-dioctyl
| Molecular Formula | C8H12O2 |
|---|---|
| Molecular Weight | 140.08 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 140.08372 |
| Heavy Atoms | 10 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 565184-50-1 |
|---|---|
| SMILES | COC(=O)C1C2CCC1C2 |
| InChIKey | QOEWQLUGTNSPSI-UHFFFAOYSA-N |
Product Overview
Methyl bicyclo[2.1.1]hexane-5-carboxylate (CAS 565184-50-1), with molecular formula C8H12O2 and molecular weight 140.08 g/mol. IUPAC: methyl bicyclo[2.1.1]hexane-5-carboxylate.
Chemical Property Profile of Methyl bicyclo[2.1.1]hexane-5-carboxylate
Property Insights of Methyl bicyclo[2.1.1]hexane-5-carboxylate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl bicyclo[2.1.1]hexane-5-carboxylate. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl bicyclo[2.1.1]hexane-5-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl bicyclo[2.1.1]hexane-5-carboxylate 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 Methyl bicyclo[2.1.1]hexane-5-carboxylate?
The CAS number of Methyl bicyclo[2.1.1]hexane-5-carboxylate is 565184-50-1.
What is the molecular formula of Methyl bicyclo[2.1.1]hexane-5-carboxylate?
The molecular formula of Methyl bicyclo[2.1.1]hexane-5-carboxylate is C8H12O2.
What is the molecular weight of Methyl bicyclo[2.1.1]hexane-5-carboxylate?
The molecular weight of Methyl bicyclo[2.1.1]hexane-5-carboxylate is 140.08 g/mol.
Where can I buy Methyl bicyclo[2.1.1]hexane-5-carboxylate?
You can request a quote for Methyl bicyclo[2.1.1]hexane-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl bicyclo[2.1.1]hexane-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl bicyclo[2.1.1]hexane-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.