1,2,4-Triazole,3-nitro-1-(2-hydroxy-3-methoxy)PR
TL;DR: 1,2,4-Triazole,3-nitro-1-(2-hydroxy-3-methoxy)PR (CAS 104958-86-3) is a chemical compound with molecular formula C6H10N4O4 and molecular weight 202.0702 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methoxy-3-(3-nitro-1,2,4-triazol-1-yl)propan-2-ol
Also Known As: J1.552.348D, 1,2,4-TRIAZOLE,3-NITRO-1-(2-HYDROXY-3-METHOXY)PR, 1-methoxy-3-(3-nitro-1H-1,2,4-triazol-1-yl)propan-2-ol, 1-methoxy-3-(3-nitro-1,2,4-triazol-1-yl)propan-2-ol, alpha-(Methoxymethyl)-3-nitro-1H-1,2,4-triazole-1-ethanol
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H10N4O4 |
| Molecular Weight | 202.0702 g/mol |
| XLogP | -0.5 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 202.0702 Da |
| Heavy Atoms | 14 |
| Complexity | 197.0 |
| SMILES | COCC(CN1C=NC(=N1)[N+](=O)[O-])O |
| InChIKey | PUGFKWCQLDZWDJ-UHFFFAOYSA-N |
Chemical Property Profile of 1,2,4-Triazole,3-nitro-1-(2-hydroxy-3-methoxy)PR
Property Insights of 1,2,4-Triazole,3-nitro-1-(2-hydroxy-3-methoxy)PR
The XLogP value of -0.5 indicates that 1,2,4-Triazole,3-nitro-1-(2-hydroxy-3-methoxy)PR is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,4-Triazole,3-nitro-1-(2-hydroxy-3-methoxy)PR. Following Lipinski's Rule of Five, 1,2,4-Triazole,3-nitro-1-(2-hydroxy-3-methoxy)PR has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,2,4-Triazole,3-nitro-1-(2-hydroxy-3-methoxy)PR?
The CAS number of 1,2,4-Triazole,3-nitro-1-(2-hydroxy-3-methoxy)PR is 104958-86-3.
What is the molecular formula of 1,2,4-Triazole,3-nitro-1-(2-hydroxy-3-methoxy)PR?
The molecular formula of 1,2,4-Triazole,3-nitro-1-(2-hydroxy-3-methoxy)PR is C6H10N4O4.
What is the molecular weight of 1,2,4-Triazole,3-nitro-1-(2-hydroxy-3-methoxy)PR?
The molecular weight of 1,2,4-Triazole,3-nitro-1-(2-hydroxy-3-methoxy)PR is 202.0702 g/mol.
Where can I buy 1,2,4-Triazole,3-nitro-1-(2-hydroxy-3-methoxy)PR?
You can request a quote for 1,2,4-Triazole,3-nitro-1-(2-hydroxy-3-methoxy)PR directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2,4-Triazole,3-nitro-1-(2-hydroxy-3-methoxy)PR?
Yes, CoreyChem provides custom synthesis services for 1,2,4-Triazole,3-nitro-1-(2-hydroxy-3-methoxy)PR and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.