(1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol
TL;DR: (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol (CAS 2964-48-9) is a chemical compound with molecular formula C9H12N2O4 and molecular weight 212.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol
Also Known As: Levoamine, (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol, (1R,2R)-(-)-2-Amino-1-(4-nitrophenyl)-1,3-propanediol, 1,3-Propanediol, 2-amino-1-(4-nitrophenyl)-, (1S,2R)-
| Molecular Formula | C9H12N2O4 |
|---|---|
| Molecular Weight | 212.08 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 212.07971 |
| Heavy Atoms | 15 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 2964-48-9 |
|---|---|
| SMILES | C1=CC(=CC=C1[C@@H]([C@@H](CO)N)O)[N+](=O)[O-] |
| InChIKey | OCYJXSUPZMNXEN-BDAKNGLRSA-N |
Product Overview
(1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol (CAS 2964-48-9), with molecular formula C9H12N2O4 and molecular weight 212.08 g/mol. IUPAC: (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol.
Chemical Property Profile of (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol
Property Insights of (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol
The XLogP value of -0.7 indicates that (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol. Following Lipinski's Rule of Five, (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol 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 (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol?
The CAS number of (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol is 2964-48-9.
What is the molecular formula of (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol?
The molecular formula of (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol is C9H12N2O4.
What is the molecular weight of (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol?
The molecular weight of (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol is 212.08 g/mol.
Where can I buy (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol?
You can request a quote for (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol?
Yes, KEHONG BIO provides custom synthesis services for (1S,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.