Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester
TL;DR: Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester (CAS 76790-22-2) is a chemical compound with molecular formula C11H15NO6S and molecular weight 289.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4-butoxybenzoyl)amino] hydrogen sulfate
Also Known As: 4-butoxy-N-(sulfooxy)benzamide, [(4-butoxybenzoyl)amino] hydrogen sulfate, 1-butoxy-4-(sulfooxycarbamoyl)benzene, Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester
| Molecular Formula | C11H15NO6S |
|---|---|
| Molecular Weight | 289.06 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 289.062 |
| Heavy Atoms | 19 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 76790-22-2 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C(=O)NOS(=O)(=O)O |
| InChIKey | VQIFKWZYSPUGAA-UHFFFAOYSA-N |
Product Overview
Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester (CAS 76790-22-2), with molecular formula C11H15NO6S and molecular weight 289.06 g/mol. IUPAC: [(4-butoxybenzoyl)amino] hydrogen sulfate.
Chemical Property Profile of Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester
Property Insights of Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester. Following Lipinski's Rule of Five, Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester has 2 hydrogen bond donor(s) and 6 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 Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester?
The CAS number of Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester is 76790-22-2.
What is the molecular formula of Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester?
The molecular formula of Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester is C11H15NO6S.
What is the molecular weight of Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester?
The molecular weight of Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester is 289.06 g/mol.
Where can I buy Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester?
You can request a quote for Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Sulfuric acid, mono((4-butoxybenzoyl)azanyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.