Coumarin-3-carboxylic acid succinimidyl ester
TL;DR: Coumarin-3-carboxylic acid succinimidyl ester (CAS 148627-84-3) is a chemical compound with molecular formula C14H9NO6 and molecular weight 287.043 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2,5-dioxopyrrolidin-1-yl) 2-oxochromene-3-carboxylate
Also Known As: Secca ester, SECCA, Coumarin-3-carboxylic acid succinimidyl ester, 2-oxochromene-3-carboxylate, Succinimidyl coumarin-3-carboxylate
Technical Specifications
| Molecular Formula | C14H9NO6 |
| Molecular Weight | 287.043 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 90.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.043 Da |
| Heavy Atoms | 21 |
| Complexity | 536.0 |
| SMILES | C1CC(=O)N(C1=O)OC(=O)C2=CC3=CC=CC=C3OC2=O |
| InChIKey | NTXGVUJAUMMHQO-UHFFFAOYSA-N |
Chemical Property Profile of Coumarin-3-carboxylic acid succinimidyl ester
Property Insights of Coumarin-3-carboxylic acid succinimidyl ester
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Coumarin-3-carboxylic acid succinimidyl ester. The TPSA of 90.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Coumarin-3-carboxylic acid succinimidyl ester. Following Lipinski's Rule of Five, Coumarin-3-carboxylic acid succinimidyl ester has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Coumarin-3-carboxylic acid succinimidyl ester?
The CAS number of Coumarin-3-carboxylic acid succinimidyl ester is 148627-84-3.
What is the molecular formula of Coumarin-3-carboxylic acid succinimidyl ester?
The molecular formula of Coumarin-3-carboxylic acid succinimidyl ester is C14H9NO6.
What is the molecular weight of Coumarin-3-carboxylic acid succinimidyl ester?
The molecular weight of Coumarin-3-carboxylic acid succinimidyl ester is 287.043 g/mol.
Where can I buy Coumarin-3-carboxylic acid succinimidyl ester?
You can request a quote for Coumarin-3-carboxylic acid succinimidyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Coumarin-3-carboxylic acid succinimidyl ester?
Yes, CoreyChem provides custom synthesis services for Coumarin-3-carboxylic acid succinimidyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.