[5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate
TL;DR: [5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate (CAS 303148-55-2) is a chemical compound with molecular formula C8H7Cl2F3N2O2 and molecular weight 289.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-chloro-1-methyl-3-(trifluoromethyl)pyrazol-4-yl]methyl 2-chloroacetate
Also Known As: [5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate|KS-00001RNW|[5-chloro-1-methyl-3-(trifluoromethyl)pyrazol-4-yl]methyl 2-chloroacetate|(5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl)methyl 2-chloroacetate|[5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl2-chloroacetate|C8H7Cl2F3N2O2|MFCD00141485
| Molecular Formula | C8H7Cl2F3N2O2 |
|---|---|
| Molecular Weight | 289.98 g/mol |
| LogP | 2.3743 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.98367 |
| Heavy Atoms | 17 |
| Complexity | 431.14017 |
Chemical Identifiers
| CAS Number | 303148-55-2 |
|---|---|
| SMILES | CN1C(=C(C(=N1)C(F)(F)F)COC(=O)CCl)Cl |
Product Overview
[5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate (CAS 303148-55-2), with molecular formula C8H7Cl2F3N2O2 and molecular weight 289.98 g/mol. IUPAC: [5-chloro-1-methyl-3-(trifluoromethyl)pyrazol-4-yl]methyl 2-chloroacetate.
Chemical Property Profile of [5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate
Property Insights of [5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate
The XLogP value of 2.3743 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate. With a topological polar surface area (TPSA) of 44.12 Ų, [5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate 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 [5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate?
The CAS number of [5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate is 303148-55-2.
What is the molecular formula of [5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate?
The molecular formula of [5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate is C8H7Cl2F3N2O2.
What is the molecular weight of [5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate?
The molecular weight of [5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate is 289.98 g/mol.
Where can I buy [5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate?
You can request a quote for [5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate?
Yes, KEHONG BIO provides custom synthesis services for [5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl 2-chloroacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.