3-Acetamido-4-methoxybenzenesulfonyl fluoride
TL;DR: 3-Acetamido-4-methoxybenzenesulfonyl fluoride (CAS 885-87-0) is a chemical compound with molecular formula C9H10FNO4S and molecular weight 247.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetamido-4-methoxybenzenesulfonyl fluoride
Also Known As: 3-acetamido-4-methoxybenzenesulfonyl fluoride, 3-acetamido-4-methoxybenzene-1-sulfonyl fluoride, 3-(acetylamino)-4-methoxybenzenesulfonyl fluoride, 3-(acetylamino)-4-methoxybenzenesulfonylfluoride, RefChem:276139
| Molecular Formula | C9H10FNO4S |
|---|---|
| Molecular Weight | 247.03 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.03146 |
| Heavy Atoms | 16 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 885-87-0 |
|---|---|
| SMILES | CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)F)OC |
| InChIKey | DPQQVRWSRIMQLT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Acetamido-4-methoxybenzenesulfonyl fluoride (CAS 885-87-0), with molecular formula C9H10FNO4S and molecular weight 247.03 g/mol. IUPAC: 3-acetamido-4-methoxybenzenesulfonyl fluoride.
Chemical Property Profile of 3-Acetamido-4-methoxybenzenesulfonyl fluoride
Property Insights of 3-Acetamido-4-methoxybenzenesulfonyl fluoride
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Acetamido-4-methoxybenzenesulfonyl fluoride. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Acetamido-4-methoxybenzenesulfonyl fluoride. Following Lipinski's Rule of Five, 3-Acetamido-4-methoxybenzenesulfonyl fluoride has 1 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 3-Acetamido-4-methoxybenzenesulfonyl fluoride?
The CAS number of 3-Acetamido-4-methoxybenzenesulfonyl fluoride is 885-87-0.
What is the molecular formula of 3-Acetamido-4-methoxybenzenesulfonyl fluoride?
The molecular formula of 3-Acetamido-4-methoxybenzenesulfonyl fluoride is C9H10FNO4S.
What is the molecular weight of 3-Acetamido-4-methoxybenzenesulfonyl fluoride?
The molecular weight of 3-Acetamido-4-methoxybenzenesulfonyl fluoride is 247.03 g/mol.
Where can I buy 3-Acetamido-4-methoxybenzenesulfonyl fluoride?
You can request a quote for 3-Acetamido-4-methoxybenzenesulfonyl fluoride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Acetamido-4-methoxybenzenesulfonyl fluoride?
Yes, KEHONG BIO provides custom synthesis services for 3-Acetamido-4-methoxybenzenesulfonyl fluoride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.