5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole
TL;DR: 5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole (CAS 204130-95-0) is a chemical compound with molecular formula C12H7F7N2 and molecular weight 312.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1,1,2,2,3,3,3-heptafluoropropyl)-3-phenyl-1H-pyrazole
Also Known As: 3-(Perfluoropropyl)-5-phenyl-1H-pyrazole, 3(5)-Heptafluoropropyl-5(3)-phenylpyrazole, 3-(heptafluoro-1-propyl)-5-phenylpyrazole, 5-(heptafluoropropyl)-3-phenyl-1H-pyrazole, 3- -5-PHENYLPYRAZOLE
| Molecular Formula | C12H7F7N2 |
|---|---|
| Molecular Weight | 312.05 g/mol |
| LogP | 4.3661 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.04974 |
| Heavy Atoms | 21 |
| Complexity | 616.0362 |
Chemical Identifiers
| CAS Number | 204130-95-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NNC(=C2)C(C(C(F)(F)F)(F)F)(F)F |
Product Overview
5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole (CAS 204130-95-0), with molecular formula C12H7F7N2 and molecular weight 312.05 g/mol. IUPAC: 5-(1,1,2,2,3,3,3-heptafluoropropyl)-3-phenyl-1H-pyrazole.
Chemical Property Profile of 5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole
Property Insights of 5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole
The XLogP value of 4.3661 indicates that 5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.68 Ų, 5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole has 1 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 5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole?
The CAS number of 5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole is 204130-95-0.
What is the molecular formula of 5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole?
The molecular formula of 5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole is C12H7F7N2.
What is the molecular weight of 5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole?
The molecular weight of 5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole is 312.05 g/mol.
Where can I buy 5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole?
You can request a quote for 5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(Heptafluoropropyl)-3-phenyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.