糖精N-(2-乙酸甲酯)
TL;DR: 糖精N-(2-乙酸甲酯) (CAS 6639-62-9) is a chemical compound with molecular formula C10H9NO5S and molecular weight 255.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
糖精N-(2-乙酸甲酯)
methyl 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetate
Also Known As: Piroxicam Impurity D, PIROXICAM EP IMPURITY D, Saccharin N-(2-Acetic Acid Methyl Ester), ChemDiv1_010182, 2-Chloro-6-fluorophenylacetonitrile
| Molecular Formula | C10H9NO5S |
|---|---|
| Molecular Weight | 255.02 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 89.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 255.02014 |
| Heavy Atoms | 17 |
| Complexity | 438.0 |
Chemical Identifiers
| CAS Number | 6639-62-9 |
|---|---|
| SMILES | COC(=O)CN1C(=O)C2=CC=CC=C2S1(=O)=O |
| InChIKey | YWLDQSMTDJWJCC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
糖精N-(2-乙酸甲酯) (CAS 6639-62-9), with molecular formula C10H9NO5S and molecular weight 255.02 g/mol. IUPAC: methyl 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetate.
Chemical Property Profile of 糖精N-(2-乙酸甲酯)
Property Insights of 糖精N-(2-乙酸甲酯)
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 糖精N-(2-乙酸甲酯). The TPSA of 89.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 糖精N-(2-乙酸甲酯). Following Lipinski's Rule of Five, 糖精N-(2-乙酸甲酯) 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
Frequently Asked Questions
What is the CAS number of 糖精N-(2-乙酸甲酯)?
The CAS number of 糖精N-(2-乙酸甲酯) is 6639-62-9.
What is the molecular formula of 糖精N-(2-乙酸甲酯)?
The molecular formula of 糖精N-(2-乙酸甲酯) is C10H9NO5S.
What is the molecular weight of 糖精N-(2-乙酸甲酯)?
The molecular weight of 糖精N-(2-乙酸甲酯) is 255.02 g/mol.
Where can I buy 糖精N-(2-乙酸甲酯)?
You can request a quote for 糖精N-(2-乙酸甲酯) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 糖精N-(2-乙酸甲酯)?
Yes, KEHONG BIO provides custom synthesis services for 糖精N-(2-乙酸甲酯) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.