Hexanoic acid, 5-(acetyloxy)-, ethyl ester
TL;DR: Hexanoic acid, 5-(acetyloxy)-, ethyl ester (CAS 35234-24-3) is a chemical compound with molecular formula C10H18O4 and molecular weight 202.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-acetyloxyhexanoate
Also Known As: ethyl 5-acetoxyhexanoate, 5- hexanoicacidethylester, ethyl 5-acetyloxyhexanoate, Ethyl 5-(acetyloxy)hexanoate, .delta.-Acetoxycaproic acid, ethyl ester
| Molecular Formula | C10H18O4 |
|---|---|
| Molecular Weight | 202.12 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 202.12051 |
| Heavy Atoms | 14 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 35234-24-3 |
|---|---|
| SMILES | CCOC(=O)CCCC(C)OC(=O)C |
| InChIKey | CVPZALWMCZAWPB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexanoic acid, 5-(acetyloxy)-, ethyl ester (CAS 35234-24-3), with molecular formula C10H18O4 and molecular weight 202.12 g/mol. IUPAC: ethyl 5-acetyloxyhexanoate.
Chemical Property Profile of Hexanoic acid, 5-(acetyloxy)-, ethyl ester
Property Insights of Hexanoic acid, 5-(acetyloxy)-, ethyl ester
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexanoic acid, 5-(acetyloxy)-, ethyl ester. With a topological polar surface area (TPSA) of 52.6 Ų, Hexanoic acid, 5-(acetyloxy)-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexanoic acid, 5-(acetyloxy)-, ethyl ester has 0 hydrogen bond donor(s) and 4 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 Hexanoic acid, 5-(acetyloxy)-, ethyl ester?
The CAS number of Hexanoic acid, 5-(acetyloxy)-, ethyl ester is 35234-24-3.
What is the molecular formula of Hexanoic acid, 5-(acetyloxy)-, ethyl ester?
The molecular formula of Hexanoic acid, 5-(acetyloxy)-, ethyl ester is C10H18O4.
What is the molecular weight of Hexanoic acid, 5-(acetyloxy)-, ethyl ester?
The molecular weight of Hexanoic acid, 5-(acetyloxy)-, ethyl ester is 202.12 g/mol.
Where can I buy Hexanoic acid, 5-(acetyloxy)-, ethyl ester?
You can request a quote for Hexanoic acid, 5-(acetyloxy)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexanoic acid, 5-(acetyloxy)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Hexanoic acid, 5-(acetyloxy)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.