(2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate
TL;DR: (2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate (CAS 5872-77-5) is a chemical compound with molecular formula C13H16N2O6 and molecular weight 296.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2R,3R)-2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate
Also Known As: (2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate, ethyl (2R,3R)-2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate
| Molecular Formula | C13H16N2O6 |
|---|---|
| Molecular Weight | 296.10 g/mol |
| LogP | 0.696 |
| Topological Polar Surface Area | 118.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 296.10083 |
| Heavy Atoms | 21 |
| Complexity | 545.21796 |
Chemical Identifiers
| CAS Number | 5872-77-5 |
|---|---|
| SMILES | CCOC(=O)[C@@H]([C@@H](C1=CC(=CC=C1)[N+](=O)[O-])O)NC(=O)C |
Product Overview
(2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate (CAS 5872-77-5), with molecular formula C13H16N2O6 and molecular weight 296.10 g/mol. IUPAC: ethyl (2R,3R)-2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate.
Chemical Property Profile of (2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate
Property Insights of (2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate
The XLogP value of 0.696 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate. The TPSA of 118.77 Ų falls within the moderate polarity range, balancing permeability and solubility for (2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate. Following Lipinski's Rule of Five, (2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate 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 (2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate?
The CAS number of (2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate is 5872-77-5.
What is the molecular formula of (2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate?
The molecular formula of (2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate is C13H16N2O6.
What is the molecular weight of (2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate?
The molecular weight of (2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate is 296.10 g/mol.
Where can I buy (2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate?
You can request a quote for (2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for (2R,3R)-ethyl 2-acetamido-3-hydroxy-3-(3-nitrophenyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.