Cyclobutanecarboxylic acid, cyclobutyl ester
TL;DR: Cyclobutanecarboxylic acid, cyclobutyl ester (CAS 42392-30-3) is a chemical compound with molecular formula C9H14O2 and molecular weight 154.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclobutyl cyclobutanecarboxylate
Also Known As: Cyclobutyl cyclobutanecarboxylate, Cyclobutyl cyclobutanecarboxylate #, cyclobutanecarboxylic acid cyclobutyl ester, Cyclobutanecarboxylic acid, cyclobutyl ester
| Molecular Formula | C9H14O2 |
|---|---|
| Molecular Weight | 154.10 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 154.09938 |
| Heavy Atoms | 11 |
| Complexity | 157.0 |
Chemical Identifiers
| CAS Number | 42392-30-3 |
|---|---|
| SMILES | C1CC(C1)C(=O)OC2CCC2 |
| InChIKey | NPJKEIYULFIWLK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclobutanecarboxylic acid, cyclobutyl ester (CAS 42392-30-3), with molecular formula C9H14O2 and molecular weight 154.10 g/mol. IUPAC: cyclobutyl cyclobutanecarboxylate.
Chemical Property Profile of Cyclobutanecarboxylic acid, cyclobutyl ester
Property Insights of Cyclobutanecarboxylic acid, cyclobutyl ester
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclobutanecarboxylic acid, cyclobutyl ester. With a topological polar surface area (TPSA) of 26.3 Ų, Cyclobutanecarboxylic acid, cyclobutyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclobutanecarboxylic acid, cyclobutyl ester 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 Cyclobutanecarboxylic acid, cyclobutyl ester?
The CAS number of Cyclobutanecarboxylic acid, cyclobutyl ester is 42392-30-3.
What is the molecular formula of Cyclobutanecarboxylic acid, cyclobutyl ester?
The molecular formula of Cyclobutanecarboxylic acid, cyclobutyl ester is C9H14O2.
What is the molecular weight of Cyclobutanecarboxylic acid, cyclobutyl ester?
The molecular weight of Cyclobutanecarboxylic acid, cyclobutyl ester is 154.10 g/mol.
Where can I buy Cyclobutanecarboxylic acid, cyclobutyl ester?
You can request a quote for Cyclobutanecarboxylic acid, cyclobutyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclobutanecarboxylic acid, cyclobutyl ester?
Yes, KEHONG BIO provides custom synthesis services for Cyclobutanecarboxylic acid, cyclobutyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.