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Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]-
TL;DR: Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]- (CAS 60007-73-0) is a chemical compound with molecular formula C8H9NO5S and molecular weight 231.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(methoxycarbonylamino)benzenesulfonic acid
Also Known As: N-carbomethoxysulfanilic acid, 4-(methoxycarbonylamino)benzenesulfonic Acid, N-Methoxycarbonyl-sulfanilsaeure, 4-[(methoxycarbonyl)amino]benzene-1-sulfonic acid, Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]-
| Molecular Formula | C8H9NO5S |
|---|---|
| Molecular Weight | 231.02 g/mol |
| LogP | 1.1116 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.02014 |
| Heavy Atoms | 15 |
| Complexity | 450.4253 |
Chemical Identifiers
| CAS Number | 60007-73-0 |
|---|---|
| SMILES | COC(=O)NC1=CC=C(C=C1)S(=O)(=O)O |
Product Overview
Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]- (CAS 60007-73-0), with molecular formula C8H9NO5S and molecular weight 231.02 g/mol. IUPAC: 4-(methoxycarbonylamino)benzenesulfonic acid.
Chemical Property Profile of Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]-
Property Insights of Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]-
The XLogP value of 1.1116 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]-. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]-. Following Lipinski's Rule of Five, Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]- 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 Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]-?
The CAS number of Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]- is 60007-73-0.
What is the molecular formula of Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]-?
The molecular formula of Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]- is C8H9NO5S.
What is the molecular weight of Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]-?
The molecular weight of Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]- is 231.02 g/mol.
Where can I buy Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]-?
You can request a quote for Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]-?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonic acid, 4-[(methoxycarbonyl)amino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.