(1-Amino-3-methylsulfinylpropyl)phosphonic acid
TL;DR: (1-Amino-3-methylsulfinylpropyl)phosphonic acid (CAS 81979-41-1) is a chemical compound with molecular formula C4H12NO4PS and molecular weight 201.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-amino-3-methylsulfinylpropyl)phosphonic acid
Also Known As: (1-amino-3-methylsulfinylpropyl)phosphonic acid, [1-Amino-3-(methanesulfinyl)propyl]phosphonic acid
| Molecular Formula | C4H12NO4PS |
|---|---|
| Molecular Weight | 201.02 g/mol |
| LogP | -5.2 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 201.02246 |
| Heavy Atoms | 11 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 81979-41-1 |
|---|---|
| SMILES | CS(=O)CCC(N)P(=O)(O)O |
| InChIKey | AQFDPNHHOMGWFQ-UHFFFAOYSA-N |
Product Overview
(1-Amino-3-methylsulfinylpropyl)phosphonic acid (CAS 81979-41-1), with molecular formula C4H12NO4PS and molecular weight 201.02 g/mol. IUPAC: (1-amino-3-methylsulfinylpropyl)phosphonic acid.
Chemical Property Profile of (1-Amino-3-methylsulfinylpropyl)phosphonic acid
Property Insights of (1-Amino-3-methylsulfinylpropyl)phosphonic acid
The XLogP value of -5.2 indicates that (1-Amino-3-methylsulfinylpropyl)phosphonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (1-Amino-3-methylsulfinylpropyl)phosphonic acid. Following Lipinski's Rule of Five, (1-Amino-3-methylsulfinylpropyl)phosphonic acid has 3 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 (1-Amino-3-methylsulfinylpropyl)phosphonic acid?
The CAS number of (1-Amino-3-methylsulfinylpropyl)phosphonic acid is 81979-41-1.
What is the molecular formula of (1-Amino-3-methylsulfinylpropyl)phosphonic acid?
The molecular formula of (1-Amino-3-methylsulfinylpropyl)phosphonic acid is C4H12NO4PS.
What is the molecular weight of (1-Amino-3-methylsulfinylpropyl)phosphonic acid?
The molecular weight of (1-Amino-3-methylsulfinylpropyl)phosphonic acid is 201.02 g/mol.
Where can I buy (1-Amino-3-methylsulfinylpropyl)phosphonic acid?
You can request a quote for (1-Amino-3-methylsulfinylpropyl)phosphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Amino-3-methylsulfinylpropyl)phosphonic acid?
Yes, KEHONG BIO provides custom synthesis services for (1-Amino-3-methylsulfinylpropyl)phosphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.