1H-Pyrazole, 3,5-dimethyl-1-nitro-
TL;DR: 1H-Pyrazole, 3,5-dimethyl-1-nitro- (CAS 70951-87-0) is a chemical compound with molecular formula C5H7N3O2 and molecular weight 141.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-1-nitropyrazole
Also Known As: 1-nitro-3,5-dimethylpyrazole, 3,5-dimethyl-1-nitropyrazole, 3,5-dimethyl-1-nitro-pyrazole, 1H-Pyrazole, 3,5-dimethyl-1-nitro-, 1H-Pyrazole, 3,5-dimethyl-1-nitro- (9CI)
| Molecular Formula | C5H7N3O2 |
|---|---|
| Molecular Weight | 141.05 g/mol |
| LogP | 0.53974 |
| Topological Polar Surface Area | 60.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 141.05383 |
| Heavy Atoms | 10 |
| Complexity | 265.8568 |
Chemical Identifiers
| CAS Number | 70951-87-0 |
|---|---|
| SMILES | CC1=CC(=NN1[N+](=O)[O-])C |
Product Overview
1H-Pyrazole, 3,5-dimethyl-1-nitro- (CAS 70951-87-0), with molecular formula C5H7N3O2 and molecular weight 141.05 g/mol. IUPAC: 3,5-dimethyl-1-nitropyrazole.
Chemical Property Profile of 1H-Pyrazole, 3,5-dimethyl-1-nitro-
Property Insights of 1H-Pyrazole, 3,5-dimethyl-1-nitro-
The XLogP value of 0.53974 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrazole, 3,5-dimethyl-1-nitro-. The TPSA of 60.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Pyrazole, 3,5-dimethyl-1-nitro-. Following Lipinski's Rule of Five, 1H-Pyrazole, 3,5-dimethyl-1-nitro- 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
Frequently Asked Questions
What is the CAS number of 1H-Pyrazole, 3,5-dimethyl-1-nitro-?
The CAS number of 1H-Pyrazole, 3,5-dimethyl-1-nitro- is 70951-87-0.
What is the molecular formula of 1H-Pyrazole, 3,5-dimethyl-1-nitro-?
The molecular formula of 1H-Pyrazole, 3,5-dimethyl-1-nitro- is C5H7N3O2.
What is the molecular weight of 1H-Pyrazole, 3,5-dimethyl-1-nitro-?
The molecular weight of 1H-Pyrazole, 3,5-dimethyl-1-nitro- is 141.05 g/mol.
Where can I buy 1H-Pyrazole, 3,5-dimethyl-1-nitro-?
You can request a quote for 1H-Pyrazole, 3,5-dimethyl-1-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrazole, 3,5-dimethyl-1-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrazole, 3,5-dimethyl-1-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.