1-Pentafluorophenyl-1,2-diazole
TL;DR: 1-Pentafluorophenyl-1,2-diazole (CAS 19005-57-3) is a chemical compound with molecular formula C9H3F5N2 and molecular weight 234.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3,4,5,6-pentafluorophenyl)pyrazole
Also Known As: N-pentafluorophenylpyrazole, 1-Pentafluorophenyl-1,2-diazole, 1-(Perfluorophenyl)-1H-pyrazole, 1-(2,3,4,5,6-pentafluorophenyl)pyrazole, 1-(2,3,4,5,6-Pentafluorophenyl)-1H-pyrazole
| Molecular Formula | C9H3F5N2 |
|---|---|
| Molecular Weight | 234.02 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 17.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 234.02164 |
| Heavy Atoms | 16 |
| Complexity | 238.0 |
Chemical Identifiers
| CAS Number | 19005-57-3 |
|---|---|
| SMILES | C1=CN(N=C1)C2=C(C(=C(C(=C2F)F)F)F)F |
| InChIKey | YJOPJGZZGKKNGG-UHFFFAOYSA-N |
Product Overview
1-Pentafluorophenyl-1,2-diazole (CAS 19005-57-3), with molecular formula C9H3F5N2 and molecular weight 234.02 g/mol. IUPAC: 1-(2,3,4,5,6-pentafluorophenyl)pyrazole.
Chemical Property Profile of 1-Pentafluorophenyl-1,2-diazole
Property Insights of 1-Pentafluorophenyl-1,2-diazole
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Pentafluorophenyl-1,2-diazole. With a topological polar surface area (TPSA) of 17.8 Ų, 1-Pentafluorophenyl-1,2-diazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pentafluorophenyl-1,2-diazole has 0 hydrogen bond donor(s) and 6 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-Pentafluorophenyl-1,2-diazole?
The CAS number of 1-Pentafluorophenyl-1,2-diazole is 19005-57-3.
What is the molecular formula of 1-Pentafluorophenyl-1,2-diazole?
The molecular formula of 1-Pentafluorophenyl-1,2-diazole is C9H3F5N2.
What is the molecular weight of 1-Pentafluorophenyl-1,2-diazole?
The molecular weight of 1-Pentafluorophenyl-1,2-diazole is 234.02 g/mol.
Where can I buy 1-Pentafluorophenyl-1,2-diazole?
You can request a quote for 1-Pentafluorophenyl-1,2-diazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pentafluorophenyl-1,2-diazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Pentafluorophenyl-1,2-diazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.