4-Acetamidobenzenesulfonate
TL;DR: 4-Acetamidobenzenesulfonate (CAS 72140-59-1) is a chemical compound with molecular formula C8H8NO4S- and molecular weight 214.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-acetamidobenzenesulfonate
Also Known As: 4-acetamidobenzenesulfonate, 4-(acetylamino)benzenesulfonate, 4-Acetylamino-benzenesulfonic acid anion, BAS 03182780, 4-(ACETYLAMINO)BENZENESULFONIC ACID
| Molecular Formula | C8H8NO4S- |
|---|---|
| Molecular Weight | 214.02 g/mol |
| LogP | 0.5491 |
| Topological Polar Surface Area | 86.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.01741 |
| Heavy Atoms | 14 |
| Complexity | 434.914 |
Chemical Identifiers
| CAS Number | 72140-59-1 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)S(=O)(=O)[O-] |
Product Overview
4-Acetamidobenzenesulfonate (CAS 72140-59-1), with molecular formula C8H8NO4S- and molecular weight 214.02 g/mol. IUPAC: 4-acetamidobenzenesulfonate.
Chemical Property Profile of 4-Acetamidobenzenesulfonate
Property Insights of 4-Acetamidobenzenesulfonate
The XLogP value of 0.5491 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Acetamidobenzenesulfonate. The TPSA of 86.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Acetamidobenzenesulfonate. Following Lipinski's Rule of Five, 4-Acetamidobenzenesulfonate 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-Acetamidobenzenesulfonate?
The CAS number of 4-Acetamidobenzenesulfonate is 72140-59-1.
What is the molecular formula of 4-Acetamidobenzenesulfonate?
The molecular formula of 4-Acetamidobenzenesulfonate is C8H8NO4S-.
What is the molecular weight of 4-Acetamidobenzenesulfonate?
The molecular weight of 4-Acetamidobenzenesulfonate is 214.02 g/mol.
Where can I buy 4-Acetamidobenzenesulfonate?
You can request a quote for 4-Acetamidobenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Acetamidobenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 4-Acetamidobenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.