4-Chloro-5-iodo-1,3-dimethylpyrazole
TL;DR: 4-Chloro-5-iodo-1,3-dimethylpyrazole (CAS 94989-96-5) is a chemical compound with molecular formula C5H6ClIN2 and molecular weight 255.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-5-iodo-1,3-dimethylpyrazole
Also Known As: 4-chloro-5-iodo-1,3-dimethylpyrazole, 4-chloro-5-iodo-1,3-dimethyl-1H-pyrazole, AI-034/31406047
| Molecular Formula | C5H6ClIN2 |
|---|---|
| Molecular Weight | 255.93 g/mol |
| LogP | 1.98652 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 255.92642 |
| Heavy Atoms | 9 |
| Complexity | 208.60703 |
Chemical Identifiers
| CAS Number | 94989-96-5 |
|---|---|
| SMILES | CC1=NN(C(=C1Cl)I)C |
Product Overview
4-Chloro-5-iodo-1,3-dimethylpyrazole (CAS 94989-96-5), with molecular formula C5H6ClIN2 and molecular weight 255.93 g/mol. IUPAC: 4-chloro-5-iodo-1,3-dimethylpyrazole.
Chemical Property Profile of 4-Chloro-5-iodo-1,3-dimethylpyrazole
Property Insights of 4-Chloro-5-iodo-1,3-dimethylpyrazole
The XLogP value of 1.98652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-5-iodo-1,3-dimethylpyrazole. With a topological polar surface area (TPSA) of 17.82 Ų, 4-Chloro-5-iodo-1,3-dimethylpyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-5-iodo-1,3-dimethylpyrazole has 0 hydrogen bond donor(s) and 1 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 4-Chloro-5-iodo-1,3-dimethylpyrazole?
The CAS number of 4-Chloro-5-iodo-1,3-dimethylpyrazole is 94989-96-5.
What is the molecular formula of 4-Chloro-5-iodo-1,3-dimethylpyrazole?
The molecular formula of 4-Chloro-5-iodo-1,3-dimethylpyrazole is C5H6ClIN2.
What is the molecular weight of 4-Chloro-5-iodo-1,3-dimethylpyrazole?
The molecular weight of 4-Chloro-5-iodo-1,3-dimethylpyrazole is 255.93 g/mol.
Where can I buy 4-Chloro-5-iodo-1,3-dimethylpyrazole?
You can request a quote for 4-Chloro-5-iodo-1,3-dimethylpyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-5-iodo-1,3-dimethylpyrazole?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-5-iodo-1,3-dimethylpyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.