丁二醛
TL;DR: 丁二醛 (CAS 638-37-9) is a chemical compound with molecular formula C4H6O2 and molecular weight 86.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丁二醛
butanedial
Also Known As: Butanedial, SUCCINALDEHYDE, Succindialdehyde, Succinic aldehyde, 1,4-Butanedione
| Molecular Formula | C4H6O2 |
|---|---|
| Molecular Weight | 86.04 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 86.03678 |
| Heavy Atoms | 6 |
| Complexity | 41.0 |
Chemical Identifiers
| CAS Number | 638-37-9 |
|---|---|
| SMILES | C(CC=O)C=O |
| InChIKey | PCSMJKASWLYICJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丁二醛 (CAS 638-37-9), with molecular formula C4H6O2 and molecular weight 86.04 g/mol. IUPAC: butanedial.
Chemical Property Profile of 丁二醛
Property Insights of 丁二醛
The XLogP value of -0.9 indicates that 丁二醛 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, 丁二醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丁二醛 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 丁二醛?
The CAS number of 丁二醛 is 638-37-9.
What is the molecular formula of 丁二醛?
The molecular formula of 丁二醛 is C4H6O2.
What is the molecular weight of 丁二醛?
The molecular weight of 丁二醛 is 86.04 g/mol.
Where can I buy 丁二醛?
You can request a quote for 丁二醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丁二醛?
Yes, KEHONG BIO provides custom synthesis services for 丁二醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.