1,3-dimethyl-5-nitro-1H-pyrazole
TL;DR: 1,3-dimethyl-5-nitro-1H-pyrazole (CAS 1170783-25-1) is a chemical compound with molecular formula C5H7N3O2 and molecular weight 141.05383 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3-dimethyl-5-nitropyrazole
Also Known As: 1,3-dimethyl-5-nitro-1H-pyrazole, 1,3-dimethyl-5-nitropyrazole, 1,3-dimethyl-5-nitro-pyrazole, 1,3-Dimethyl-4-nitro-1H-pyrazole, H47171
Technical Specifications
| Molecular Formula | C5H7N3O2 |
| Molecular Weight | 141.05383 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 141.05383 Da |
| Heavy Atoms | 10 |
| Complexity | 144.0 |
| SMILES | CC1=NN(C(=C1)[N+](=O)[O-])C |
| InChIKey | OJETWFRFVGLXPW-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-dimethyl-5-nitro-1H-pyrazole
Property Insights of 1,3-dimethyl-5-nitro-1H-pyrazole
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-dimethyl-5-nitro-1H-pyrazole. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-dimethyl-5-nitro-1H-pyrazole. Following Lipinski's Rule of Five, 1,3-dimethyl-5-nitro-1H-pyrazole has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,3-dimethyl-5-nitro-1H-pyrazole?
The CAS number of 1,3-dimethyl-5-nitro-1H-pyrazole is 1170783-25-1.
What is the molecular formula of 1,3-dimethyl-5-nitro-1H-pyrazole?
The molecular formula of 1,3-dimethyl-5-nitro-1H-pyrazole is C5H7N3O2.
What is the molecular weight of 1,3-dimethyl-5-nitro-1H-pyrazole?
The molecular weight of 1,3-dimethyl-5-nitro-1H-pyrazole is 141.05383 g/mol.
Where can I buy 1,3-dimethyl-5-nitro-1H-pyrazole?
You can request a quote for 1,3-dimethyl-5-nitro-1H-pyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-dimethyl-5-nitro-1H-pyrazole?
Yes, CoreyChem provides custom synthesis services for 1,3-dimethyl-5-nitro-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.