2-氨基-1-丁醇硫酸氢酯
TL;DR: 2-氨基-1-丁醇硫酸氢酯 (CAS 68541-04-8) is a chemical compound with molecular formula C4H11NO4S and molecular weight 169.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氨基-1-丁醇硫酸氢酯
2-aminobutyl hydrogen sulfate
Also Known As: 2-Aminobutyl hydrogen sulfate, 2-Aminobutyl hydrogen sulphate, 2-aminobutylhydrogensulphate, (2-aminobutoxy)sulfonic acid, 1-Butanol, 2-amino-, 1-(hydrogen sulfate)
| Molecular Formula | C4H11NO4S |
|---|---|
| Molecular Weight | 169.04 g/mol |
| LogP | -3.1 |
| Topological Polar Surface Area | 98.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 169.04088 |
| Heavy Atoms | 10 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 68541-04-8 |
|---|---|
| SMILES | CCC(COS(=O)(=O)O)N |
| InChIKey | UATUYFCJVAFDRY-UHFFFAOYSA-N |
Product Overview
2-氨基-1-丁醇硫酸氢酯 (CAS 68541-04-8), with molecular formula C4H11NO4S and molecular weight 169.04 g/mol. IUPAC: 2-aminobutyl hydrogen sulfate.
Chemical Property Profile of 2-氨基-1-丁醇硫酸氢酯
Property Insights of 2-氨基-1-丁醇硫酸氢酯
The XLogP value of -3.1 indicates that 2-氨基-1-丁醇硫酸氢酯 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-氨基-1-丁醇硫酸氢酯. Following Lipinski's Rule of Five, 2-氨基-1-丁醇硫酸氢酯 has 2 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 2-氨基-1-丁醇硫酸氢酯?
The CAS number of 2-氨基-1-丁醇硫酸氢酯 is 68541-04-8.
What is the molecular formula of 2-氨基-1-丁醇硫酸氢酯?
The molecular formula of 2-氨基-1-丁醇硫酸氢酯 is C4H11NO4S.
What is the molecular weight of 2-氨基-1-丁醇硫酸氢酯?
The molecular weight of 2-氨基-1-丁醇硫酸氢酯 is 169.04 g/mol.
Where can I buy 2-氨基-1-丁醇硫酸氢酯?
You can request a quote for 2-氨基-1-丁醇硫酸氢酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氨基-1-丁醇硫酸氢酯?
Yes, KEHONG BIO provides custom synthesis services for 2-氨基-1-丁醇硫酸氢酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.