γ-己内酯
TL;DR: γ-己内酯 (CAS 695-06-7) is a chemical compound with molecular formula C6H10O2 and molecular weight 114.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
γ-己内酯
5-ethyloxolan-2-one
Also Known As: gamma-Caprolactone, gamma-Hexalactone, 4-Hexanolide, gamma-Hexanolactone, 6-Caprolactone
| Molecular Formula | C6H10O2 |
|---|---|
| Molecular Weight | 114.07 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 114.06808 |
| Heavy Atoms | 8 |
| Complexity | 98.0 |
| Melting Point | -18 °C |
| Boiling Point | 100.00 to 102.00 °C. @ 18.00 mm Hg |
| Density | 1.020-1.025 |
| Solubility | slightly |
| Refractive Index | 1.437-1.442 |
Chemical Identifiers
| CAS Number | 695-06-7 |
|---|---|
| SMILES | CCC1CCC(=O)O1 |
| InChIKey | JBFHTYHTHYHCDJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
γ-己内酯 (CAS 695-06-7), with molecular formula C6H10O2 and molecular weight 114.07 g/mol. IUPAC: 5-ethyloxolan-2-one.
Chemical Property Profile of γ-己内酯
Property Insights of γ-己内酯
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for γ-己内酯. With a topological polar surface area (TPSA) of 26.3 Ų, γ-己内酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, γ-己内酯 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 γ-己内酯?
The CAS number of γ-己内酯 is 695-06-7.
What is the molecular formula of γ-己内酯?
The molecular formula of γ-己内酯 is C6H10O2.
What is the molecular weight of γ-己内酯?
The molecular weight of γ-己内酯 is 114.07 g/mol.
Where can I buy γ-己内酯?
You can request a quote for γ-己内酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for γ-己内酯?
Yes, KEHONG BIO provides custom synthesis services for γ-己内酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.