Bromoacetylsulfanilic acid
TL;DR: Bromoacetylsulfanilic acid (CAS 61389-09-1) is a chemical compound with molecular formula C8H11BrN2O4S and molecular weight 309.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azanium 4-[(2-bromoacetyl)amino]benzenesulfonate
Also Known As: Bromoacetylsulfanilic acid, Ammonium bromoacetylsulfanilate, Bromoacetylsulfanilic acid ammonium salt, azanium;4-[(2-bromoacetyl)amino]benzenesulfonate, azanium 4-[(2-bromoacetyl)amino]benzenesulfonate
| Molecular Formula | C8H11BrN2O4S |
|---|---|
| Molecular Weight | 309.96 g/mol |
| LogP | 1.3003 |
| Topological Polar Surface Area | 122.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.96228 |
| Heavy Atoms | 16 |
| Complexity | 457.43158 |
Chemical Identifiers
| CAS Number | 61389-09-1 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)CBr)S(=O)(=O)[O-].[NH4+] |
Product Overview
Bromoacetylsulfanilic acid (CAS 61389-09-1), with molecular formula C8H11BrN2O4S and molecular weight 309.96 g/mol. IUPAC: azanium 4-[(2-bromoacetyl)amino]benzenesulfonate.
Chemical Property Profile of Bromoacetylsulfanilic acid
Property Insights of Bromoacetylsulfanilic acid
The XLogP value of 1.3003 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bromoacetylsulfanilic acid. The TPSA of 122.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Bromoacetylsulfanilic acid. Following Lipinski's Rule of Five, Bromoacetylsulfanilic acid has 2 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 Bromoacetylsulfanilic acid?
The CAS number of Bromoacetylsulfanilic acid is 61389-09-1.
What is the molecular formula of Bromoacetylsulfanilic acid?
The molecular formula of Bromoacetylsulfanilic acid is C8H11BrN2O4S.
What is the molecular weight of Bromoacetylsulfanilic acid?
The molecular weight of Bromoacetylsulfanilic acid is 309.96 g/mol.
Where can I buy Bromoacetylsulfanilic acid?
You can request a quote for Bromoacetylsulfanilic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bromoacetylsulfanilic acid?
Yes, KEHONG BIO provides custom synthesis services for Bromoacetylsulfanilic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.