丙二醛
TL;DR: 丙二醛 (CAS 542-78-9) is a chemical compound with molecular formula C3H4O2 and molecular weight 72.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丙二醛
propanedial
Also Known As: Propanedial, Malondialdehyde, MALONALDEHYDE, Malonodialdehyde, Malonic aldehyde
| Molecular Formula | C3H4O2 |
|---|---|
| Molecular Weight | 72.02 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 72.021126 |
| Heavy Atoms | 5 |
| Complexity | 34.0 |
| Melting Point | 72 °C |
Chemical Identifiers
| CAS Number | 542-78-9 |
|---|---|
| SMILES | C(C=O)C=O |
| InChIKey | WSMYVTOQOOLQHP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丙二醛 (CAS 542-78-9), with molecular formula C3H4O2 and molecular weight 72.02 g/mol. IUPAC: propanedial.
Chemical Property Profile of 丙二醛
Property Insights of 丙二醛
The XLogP value of -0.6 indicates that 丙二醛 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 34.1 Ų, 丙二醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丙二醛 has 0 hydrogen bond donor(s) and 2 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 丙二醛?
The CAS number of 丙二醛 is 542-78-9.
What is the molecular formula of 丙二醛?
The molecular formula of 丙二醛 is C3H4O2.
What is the molecular weight of 丙二醛?
The molecular weight of 丙二醛 is 72.02 g/mol.
Where can I buy 丙二醛?
You can request a quote for 丙二醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丙二醛?
Yes, KEHONG BIO provides custom synthesis services for 丙二醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.