Propyl 1-hydroxycyclohexanecarboxylate
TL;DR: Propyl 1-hydroxycyclohexanecarboxylate (CAS 10596-19-7) is a chemical compound with molecular formula C10H18O3 and molecular weight 186.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 1-hydroxycyclohexane-1-carboxylate
Also Known As: propyl 1-hydroxycyclohexanecarboxylate, propyl 1-hydroxycyclohexane-1-carboxylate, Cyclohexanecarboxylicacid, 1-hydroxy-, propyl ester
| Molecular Formula | C10H18O3 |
|---|---|
| Molecular Weight | 186.13 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 186.1256 |
| Heavy Atoms | 13 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 10596-19-7 |
|---|---|
| SMILES | CCCOC(=O)C1(CCCCC1)O |
| InChIKey | NGVNZVCESYXGTF-UHFFFAOYSA-N |
Product Overview
Propyl 1-hydroxycyclohexanecarboxylate (CAS 10596-19-7), with molecular formula C10H18O3 and molecular weight 186.13 g/mol. IUPAC: propyl 1-hydroxycyclohexane-1-carboxylate.
Chemical Property Profile of Propyl 1-hydroxycyclohexanecarboxylate
Property Insights of Propyl 1-hydroxycyclohexanecarboxylate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propyl 1-hydroxycyclohexanecarboxylate. With a topological polar surface area (TPSA) of 46.5 Ų, Propyl 1-hydroxycyclohexanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propyl 1-hydroxycyclohexanecarboxylate has 1 hydrogen bond donor(s) and 3 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 1-hydroxycyclohexanecarboxylate?
The CAS number of Propyl 1-hydroxycyclohexanecarboxylate is 10596-19-7.
What is the molecular formula of Propyl 1-hydroxycyclohexanecarboxylate?
The molecular formula of Propyl 1-hydroxycyclohexanecarboxylate is C10H18O3.
What is the molecular weight of Propyl 1-hydroxycyclohexanecarboxylate?
The molecular weight of Propyl 1-hydroxycyclohexanecarboxylate is 186.13 g/mol.
Where can I buy Propyl 1-hydroxycyclohexanecarboxylate?
You can request a quote for Propyl 1-hydroxycyclohexanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl 1-hydroxycyclohexanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Propyl 1-hydroxycyclohexanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.