(2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid
TL;DR: (2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid (CAS 135093-66-2) is a chemical compound with molecular formula C6H12NO5P and molecular weight 209.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-acetamido-4-hydroxyphosphonoylbutanoic acid
Also Known As: N-Adpt, N-Acetyldemethylphosphinothricin, (2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid, RefChem:905866
| Molecular Formula | C6H12NO5P |
|---|---|
| Molecular Weight | 209.05 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 209.0453 |
| Heavy Atoms | 13 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 135093-66-2 |
|---|---|
| SMILES | CC(=O)N[C@@H](CCP(=O)O)C(=O)O |
| InChIKey | VMEBCHDZEJWXIU-YFKPBYRVSA-N |
Product Overview
(2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid (CAS 135093-66-2), with molecular formula C6H12NO5P and molecular weight 209.05 g/mol. IUPAC: (2S)-2-acetamido-4-hydroxyphosphonoylbutanoic acid.
Chemical Property Profile of (2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid
Property Insights of (2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid
The XLogP value of -1.8 indicates that (2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid. Following Lipinski's Rule of Five, (2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid has 3 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 (2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid?
The CAS number of (2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid is 135093-66-2.
What is the molecular formula of (2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid?
The molecular formula of (2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid is C6H12NO5P.
What is the molecular weight of (2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid?
The molecular weight of (2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid is 209.05 g/mol.
Where can I buy (2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid?
You can request a quote for (2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-(Acetylamino)-4-(hydroxyphosphinyl)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.