甲酰乙酸
TL;DR: 甲酰乙酸 (CAS 926-61-4) is a chemical compound with molecular formula C3H4O3 and molecular weight 88.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲酰乙酸
3-oxopropanoic acid
Also Known As: 3-oxopropanoic acid, Malonic semialdehyde, formylacetic acid, 3-oxopropanoate, 3-Oxopropionic acid
| Molecular Formula | C3H4O3 |
|---|---|
| Molecular Weight | 88.02 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 88.016045 |
| Heavy Atoms | 6 |
| Complexity | 66.0 |
Chemical Identifiers
| CAS Number | 926-61-4 |
|---|---|
| SMILES | C(C=O)C(=O)O |
| InChIKey | OAKURXIZZOAYBC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲酰乙酸 (CAS 926-61-4), with molecular formula C3H4O3 and molecular weight 88.02 g/mol. IUPAC: 3-oxopropanoic acid.
Chemical Property Profile of 甲酰乙酸
Property Insights of 甲酰乙酸
The XLogP value of -0.6 indicates that 甲酰乙酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 54.4 Ų, 甲酰乙酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲酰乙酸 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 甲酰乙酸?
The CAS number of 甲酰乙酸 is 926-61-4.
What is the molecular formula of 甲酰乙酸?
The molecular formula of 甲酰乙酸 is C3H4O3.
What is the molecular weight of 甲酰乙酸?
The molecular weight of 甲酰乙酸 is 88.02 g/mol.
Where can I buy 甲酰乙酸?
You can request a quote for 甲酰乙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲酰乙酸?
Yes, KEHONG BIO provides custom synthesis services for 甲酰乙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.