1-Nitroproline
TL;DR: 1-Nitroproline (CAS 64693-50-1) is a chemical compound with molecular formula C5H8N2O4 and molecular weight 160.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-1-nitropyrrolidine-2-carboxylic acid
Also Known As: 1-Nitro-D-proline, 1-nitroproline, D-Proline, 1-nitro-, 1-Nitro-D-prolin, D-Proline, 1-nitro- (9CI)
| Molecular Formula | C5H8N2O4 |
|---|---|
| Molecular Weight | 160.05 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 86.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.0484 |
| Heavy Atoms | 11 |
| Complexity | 187.0 |
Chemical Identifiers
| CAS Number | 64693-50-1 |
|---|---|
| SMILES | C1C[C@@H](N(C1)[N+](=O)[O-])C(=O)O |
| InChIKey | CSDIOFGVLSDOSG-SCSAIBSYSA-N |
Product Overview
1-Nitroproline (CAS 64693-50-1), with molecular formula C5H8N2O4 and molecular weight 160.05 g/mol. IUPAC: (2R)-1-nitropyrrolidine-2-carboxylic acid.
Chemical Property Profile of 1-Nitroproline
Property Insights of 1-Nitroproline
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Nitroproline. The TPSA of 86.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Nitroproline. Following Lipinski's Rule of Five, 1-Nitroproline has 1 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 1-Nitroproline?
The CAS number of 1-Nitroproline is 64693-50-1.
What is the molecular formula of 1-Nitroproline?
The molecular formula of 1-Nitroproline is C5H8N2O4.
What is the molecular weight of 1-Nitroproline?
The molecular weight of 1-Nitroproline is 160.05 g/mol.
Where can I buy 1-Nitroproline?
You can request a quote for 1-Nitroproline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Nitroproline?
Yes, KEHONG BIO provides custom synthesis services for 1-Nitroproline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.