丙酮酸
TL;DR: 丙酮酸 (CAS 127-17-3) 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.
丙酮酸
2-oxopropanoic acid
Also Known As: Pyruvic acid, 2-Oxopropanoic acid, acetylformic acid, Pyroracemic acid, pyruvate
| Molecular Formula | C3H4O3 |
|---|---|
| Molecular Weight | 88.02 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 88.016045 |
| Heavy Atoms | 6 |
| Complexity | 84.0 |
| Melting Point | 13.8 |
| Boiling Point | 54 |
| Density | 1.260-1.281 |
| Solubility | 1000000 |
| Vapor Pressure | 1.29 [mmHg] |
| Refractive Index | 1.424-1.435 |
| GHS Signal | Danger |
| H-Statements | H314 |
Chemical Identifiers
| CAS Number | 127-17-3 |
|---|---|
| SMILES | CC(=O)C(=O)O |
| InChIKey | LCTONWCANYUPML-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丙酮酸 (CAS 127-17-3), with molecular formula C3H4O3 and molecular weight 88.02 g/mol. IUPAC: 2-oxopropanoic acid.
Chemical Property Profile of 丙酮酸
Property Insights of 丙酮酸
The XLogP value of -0.3 indicates that 丙酮酸 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, 丙酮酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丙酮酸 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 丙酮酸?
The CAS number of 丙酮酸 is 127-17-3.
What is the molecular formula of 丙酮酸?
The molecular formula of 丙酮酸 is C3H4O3.
What is the molecular weight of 丙酮酸?
The molecular weight of 丙酮酸 is 88.02 g/mol.
Where can I buy 丙酮酸?
You can request a quote for 丙酮酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丙酮酸?
Yes, KEHONG BIO provides custom synthesis services for 丙酮酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.