硫代硫酸S-(6-氨基己基)酯
TL;DR: 硫代硫酸S-(6-氨基己基)酯 (CAS 21679-18-5) is a chemical compound with molecular formula C6H15NO3S2 and molecular weight 213.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫代硫酸S-(6-氨基己基)酯
1-amino-6-sulfosulfanylhexane
Also Known As: 1-amino-6-sulfosulfanylhexane, Thiosulfuric acid, 6-aminohexyl ester, 1-HEXANETHIOL, 6-AMINO-, HYDROGEN SULFATE (ester), S-(6-Aminohexyl) hydrogen sulfurothioate, thiosulfuric acid S-(6-amino-hexyl ester)
| Molecular Formula | C6H15NO3S2 |
|---|---|
| Molecular Weight | 213.05 g/mol |
| LogP | -2.2 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 213.04933 |
| Heavy Atoms | 12 |
| Complexity | 185.0 |
Chemical Identifiers
| CAS Number | 21679-18-5 |
|---|---|
| SMILES | C(CCCSS(=O)(=O)O)CCN |
| InChIKey | FVAITYGYNLHBDF-UHFFFAOYSA-N |
Product Overview
硫代硫酸S-(6-氨基己基)酯 (CAS 21679-18-5), with molecular formula C6H15NO3S2 and molecular weight 213.05 g/mol. IUPAC: 1-amino-6-sulfosulfanylhexane.
Chemical Property Profile of 硫代硫酸S-(6-氨基己基)酯
Property Insights of 硫代硫酸S-(6-氨基己基)酯
The XLogP value of -2.2 indicates that 硫代硫酸S-(6-氨基己基)酯 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 硫代硫酸S-(6-氨基己基)酯. Following Lipinski's Rule of Five, 硫代硫酸S-(6-氨基己基)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 硫代硫酸S-(6-氨基己基)酯?
The CAS number of 硫代硫酸S-(6-氨基己基)酯 is 21679-18-5.
What is the molecular formula of 硫代硫酸S-(6-氨基己基)酯?
The molecular formula of 硫代硫酸S-(6-氨基己基)酯 is C6H15NO3S2.
What is the molecular weight of 硫代硫酸S-(6-氨基己基)酯?
The molecular weight of 硫代硫酸S-(6-氨基己基)酯 is 213.05 g/mol.
Where can I buy 硫代硫酸S-(6-氨基己基)酯?
You can request a quote for 硫代硫酸S-(6-氨基己基)酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫代硫酸S-(6-氨基己基)酯?
Yes, KEHONG BIO provides custom synthesis services for 硫代硫酸S-(6-氨基己基)酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.