![2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal structure](/static/products/5605/56050-08-9.webp)
2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal
TL;DR: 2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal (CAS 56050-08-9) is a chemical compound with molecular formula C10H13NO4 and molecular weight 211.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal
Also Known As: Enicoflavine, 2-[3-(aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal, 2H-Pyran-4-acetaldehyde, 3-(aminomethylene)-alpha-ethenyltetrahydro-4-hydroxy-2-oxo-, 2H-Pyran-4-acetaldehyde, 3-(aminomethylene)-I+/--ethenyltetrahydro-4-hydroxy-2-oxo-, 3-(Aminomethylene)-alpha-ethenyltetrahydro-4-hydroxy-2-oxo-2H-pyran-4-acetaldehyde
| Molecular Formula | C10H13NO4 |
|---|---|
| Molecular Weight | 211.08 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 89.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 211.08446 |
| Heavy Atoms | 15 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 56050-08-9 |
|---|---|
| SMILES | C=CC(C=O)C1(CCOC(=O)C1=CN)O |
| InChIKey | GBJQPSBGSKNYHV-UHFFFAOYSA-N |
Product Overview
2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal (CAS 56050-08-9), with molecular formula C10H13NO4 and molecular weight 211.08 g/mol. IUPAC: 2-[3-(aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal.
Chemical Property Profile of 2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal
Property Insights of 2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal. The TPSA of 89.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal. Following Lipinski's Rule of Five, 2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal has 2 hydrogen bond donor(s) and 5 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 2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal?
The CAS number of 2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal is 56050-08-9.
What is the molecular formula of 2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal?
The molecular formula of 2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal is C10H13NO4.
What is the molecular weight of 2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal?
The molecular weight of 2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal is 211.08 g/mol.
Where can I buy 2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal?
You can request a quote for 2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(Aminomethylidene)-4-hydroxy-2-oxooxan-4-yl]but-3-enal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.