N-Hydroxysuccinimidyl acetoacetate
TL;DR: N-Hydroxysuccinimidyl acetoacetate (CAS 139549-71-6) is a chemical compound with molecular formula C8H9NO5 and molecular weight 199.04807 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2,5-dioxopyrrolidin-1-yl) 3-oxobutanoate
Also Known As: N-Hydroxysuccinimidyl acetoacetate, 2,5-dioxopyrrolidin-1-yl 3-oxobutanoate, (2,5-dioxopyrrolidin-1-yl) 3-oxobutanoate, 2,5-dioxoazolidinyl 3-oxobutanoate, Acetoacetic acid succinimidyl ester
Technical Specifications
| Molecular Formula | C8H9NO5 |
| Molecular Weight | 199.04807 g/mol |
| XLogP | -0.9 |
| Topological Polar Surface Area (TPSA) | 80.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 199.04807 Da |
| Heavy Atoms | 14 |
| Complexity | 293.0 |
| SMILES | CC(=O)CC(=O)ON1C(=O)CCC1=O |
| InChIKey | VOIVNIGJPPFYCC-UHFFFAOYSA-N |
Chemical Property Profile of N-Hydroxysuccinimidyl acetoacetate
Property Insights of N-Hydroxysuccinimidyl acetoacetate
The XLogP value of -0.9 indicates that N-Hydroxysuccinimidyl acetoacetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 80.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Hydroxysuccinimidyl acetoacetate. Following Lipinski's Rule of Five, N-Hydroxysuccinimidyl acetoacetate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-Hydroxysuccinimidyl acetoacetate?
The CAS number of N-Hydroxysuccinimidyl acetoacetate is 139549-71-6.
What is the molecular formula of N-Hydroxysuccinimidyl acetoacetate?
The molecular formula of N-Hydroxysuccinimidyl acetoacetate is C8H9NO5.
What is the molecular weight of N-Hydroxysuccinimidyl acetoacetate?
The molecular weight of N-Hydroxysuccinimidyl acetoacetate is 199.04807 g/mol.
Where can I buy N-Hydroxysuccinimidyl acetoacetate?
You can request a quote for N-Hydroxysuccinimidyl acetoacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-Hydroxysuccinimidyl acetoacetate?
Yes, CoreyChem provides custom synthesis services for N-Hydroxysuccinimidyl acetoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.