(4-乙酰氨基苯基)甲磺酸酯
TL;DR: (4-乙酰氨基苯基)甲磺酸酯 (CAS 219319-55-8) is a chemical compound with molecular formula C9H11NO4S and molecular weight 229.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-乙酰氨基苯基)甲磺酸酯
(4-acetamidophenyl) methanesulfonate
Also Known As: 4-Acetamidophenyl methanesulfonate, starbld0008541, (4-acetamidophenyl) methanesulfonate, 4-(acetylamino)phenyl methanesulfonate, Methanesulfonic acid 4-(acetylamino)phenyl ester
| Molecular Formula | C9H11NO4S |
|---|---|
| Molecular Weight | 229.04 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 229.04088 |
| Heavy Atoms | 15 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 219319-55-8 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)OS(=O)(=O)C |
| InChIKey | UXIAKHQKXGYHCA-UHFFFAOYSA-N |
Product Overview
(4-乙酰氨基苯基)甲磺酸酯 (CAS 219319-55-8), with molecular formula C9H11NO4S and molecular weight 229.04 g/mol. IUPAC: (4-acetamidophenyl) methanesulfonate.
Chemical Property Profile of (4-乙酰氨基苯基)甲磺酸酯
Property Insights of (4-乙酰氨基苯基)甲磺酸酯
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-乙酰氨基苯基)甲磺酸酯. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-乙酰氨基苯基)甲磺酸酯. Following Lipinski's Rule of Five, (4-乙酰氨基苯基)甲磺酸酯 has 1 hydrogen bond donor(s) and 4 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 (4-乙酰氨基苯基)甲磺酸酯?
The CAS number of (4-乙酰氨基苯基)甲磺酸酯 is 219319-55-8.
What is the molecular formula of (4-乙酰氨基苯基)甲磺酸酯?
The molecular formula of (4-乙酰氨基苯基)甲磺酸酯 is C9H11NO4S.
What is the molecular weight of (4-乙酰氨基苯基)甲磺酸酯?
The molecular weight of (4-乙酰氨基苯基)甲磺酸酯 is 229.04 g/mol.
Where can I buy (4-乙酰氨基苯基)甲磺酸酯?
You can request a quote for (4-乙酰氨基苯基)甲磺酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-乙酰氨基苯基)甲磺酸酯?
Yes, KEHONG BIO provides custom synthesis services for (4-乙酰氨基苯基)甲磺酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.