Propyl cyclohexanecarboxylate
TL;DR: Propyl cyclohexanecarboxylate (CAS 6739-34-0) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl cyclohexanecarboxylate
Also Known As: Propyl cyclohexanecarboxylate, 2-METHYLPYRAZINE, Cyclohexanecarboxylic acid, propyl ester, propylcyclohexanecarboxylate, Propyl cyclohexanecarboxylate #
| Molecular Formula | C10H18O2 |
|---|---|
| Molecular Weight | 170.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 170.13068 |
| Heavy Atoms | 12 |
| Complexity | 137.0 |
Chemical Identifiers
| CAS Number | 6739-34-0 |
|---|---|
| SMILES | CCCOC(=O)C1CCCCC1 |
| InChIKey | UBEVLTHYAFYOEU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propyl cyclohexanecarboxylate (CAS 6739-34-0), with molecular formula C10H18O2 and molecular weight 170.13 g/mol. IUPAC: propyl cyclohexanecarboxylate.
Chemical Property Profile of Propyl cyclohexanecarboxylate
Property Insights of Propyl cyclohexanecarboxylate
The XLogP value of 3.1 indicates that Propyl cyclohexanecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Propyl cyclohexanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propyl cyclohexanecarboxylate 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 Propyl cyclohexanecarboxylate?
The CAS number of Propyl cyclohexanecarboxylate is 6739-34-0.
What is the molecular formula of Propyl cyclohexanecarboxylate?
The molecular formula of Propyl cyclohexanecarboxylate is C10H18O2.
What is the molecular weight of Propyl cyclohexanecarboxylate?
The molecular weight of Propyl cyclohexanecarboxylate is 170.13 g/mol.
Where can I buy Propyl cyclohexanecarboxylate?
You can request a quote for Propyl cyclohexanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl cyclohexanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Propyl cyclohexanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.