3-Methoxypropionic acid
TL;DR: 3-Methoxypropionic acid (CAS 40136-09-2) is a chemical compound with molecular formula COCCC(=O)O and molecular weight 104.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxypropanoic acid
Also Known As: 3-Methoxypropanoic acid, 3-Methoxypropionic acid, m-PEG1-acid, Propanoic acid, 3-methoxy-, Methoxypropionic acid
| Molecular Formula | COCCC(=O)O |
|---|---|
| Molecular Weight | 104.05 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 104.04734 |
| Heavy Atoms | 7 |
| Complexity | 60.0 |
Chemical Identifiers
| CAS Number | 40136-09-2 |
|---|---|
| SMILES | COCCC(=O)O |
| InChIKey | YSIKHBWUBSFBRZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methoxypropionic acid (CAS 40136-09-2), with molecular formula COCCC(=O)O and molecular weight 104.05 g/mol. IUPAC: 3-methoxypropanoic acid.
Chemical Property Profile of 3-Methoxypropionic acid
Property Insights of 3-Methoxypropionic acid
The XLogP value of -0.4 indicates that 3-Methoxypropionic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.5 Ų, 3-Methoxypropionic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methoxypropionic 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 3-Methoxypropionic acid?
The CAS number of 3-Methoxypropionic acid is 40136-09-2.
What is the molecular formula of 3-Methoxypropionic acid?
The molecular formula of 3-Methoxypropionic acid is COCCC(=O)O.
What is the molecular weight of 3-Methoxypropionic acid?
The molecular weight of 3-Methoxypropionic acid is 104.05 g/mol.
Where can I buy 3-Methoxypropionic acid?
You can request a quote for 3-Methoxypropionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxypropionic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxypropionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.