4-Methoxypentanoic acid
TL;DR: 4-Methoxypentanoic acid (CAS 818-65-5) is a chemical compound with molecular formula C6H12O3 and molecular weight 132.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxypentanoic acid
Also Known As: 4-methoxypentanoic acid, 4-methoxypentanoicacid, J3.199.222B, 868-484-3, RefChem:524794
| Molecular Formula | C6H12O3 |
|---|---|
| Molecular Weight | 132.08 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 132.07864 |
| Heavy Atoms | 9 |
| Complexity | 90.0 |
Chemical Identifiers
| CAS Number | 818-65-5 |
|---|---|
| SMILES | CC(CCC(=O)O)OC |
| InChIKey | NNADTHRVGBWACO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methoxypentanoic acid (CAS 818-65-5), with molecular formula C6H12O3 and molecular weight 132.08 g/mol. IUPAC: 4-methoxypentanoic acid.
Chemical Property Profile of 4-Methoxypentanoic acid
Property Insights of 4-Methoxypentanoic acid
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxypentanoic acid. With a topological polar surface area (TPSA) of 46.5 Ų, 4-Methoxypentanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxypentanoic acid 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 4-Methoxypentanoic acid?
The CAS number of 4-Methoxypentanoic acid is 818-65-5.
What is the molecular formula of 4-Methoxypentanoic acid?
The molecular formula of 4-Methoxypentanoic acid is C6H12O3.
What is the molecular weight of 4-Methoxypentanoic acid?
The molecular weight of 4-Methoxypentanoic acid is 132.08 g/mol.
Where can I buy 4-Methoxypentanoic acid?
You can request a quote for 4-Methoxypentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxypentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxypentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.