Propan-2-yl cyclobutanecarboxylate
TL;DR: Propan-2-yl cyclobutanecarboxylate (CAS 959062-59-0) 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.
propan-2-yl cyclobutanecarboxylate
Also Known As: Isopropyl cyclobutanecarboxylate, propan-2-yl cyclobutanecarboxylate, Isopropyl cyclobutanecarboxylate #, Cyclobutanecarboxylic acid, isopropyl ester
| Molecular Formula | C8H14O2 |
|---|---|
| Molecular Weight | 142.10 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 142.09938 |
| Heavy Atoms | 10 |
| Complexity | 125.0 |
Chemical Identifiers
| CAS Number | 959062-59-0 |
|---|---|
| SMILES | CC(C)OC(=O)C1CCC1 |
| InChIKey | DSGZFARTPKZBBI-UHFFFAOYSA-N |
Product Overview
Propan-2-yl cyclobutanecarboxylate (CAS 959062-59-0), with molecular formula C8H14O2 and molecular weight 142.10 g/mol. IUPAC: propan-2-yl cyclobutanecarboxylate.
Chemical Property Profile of Propan-2-yl cyclobutanecarboxylate
Property Insights of Propan-2-yl cyclobutanecarboxylate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propan-2-yl cyclobutanecarboxylate. With a topological polar surface area (TPSA) of 26.3 Ų, Propan-2-yl cyclobutanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propan-2-yl cyclobutanecarboxylate 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 Propan-2-yl cyclobutanecarboxylate?
The CAS number of Propan-2-yl cyclobutanecarboxylate is 959062-59-0.
What is the molecular formula of Propan-2-yl cyclobutanecarboxylate?
The molecular formula of Propan-2-yl cyclobutanecarboxylate is C8H14O2.
What is the molecular weight of Propan-2-yl cyclobutanecarboxylate?
The molecular weight of Propan-2-yl cyclobutanecarboxylate is 142.10 g/mol.
Where can I buy Propan-2-yl cyclobutanecarboxylate?
You can request a quote for Propan-2-yl cyclobutanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propan-2-yl cyclobutanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Propan-2-yl cyclobutanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.