![Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate structure](/static/products/3390/339010-47-8.webp)
Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate
TL;DR: Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate (CAS 339010-47-8) is a chemical compound with molecular formula C16H13ClF3NO2 and molecular weight 343.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate
Also Known As: benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate, benzyl 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]propanoate, 7G-021, benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridyl]propanoate, benzyl2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]propanoate
| Molecular Formula | C16H13ClF3NO2 |
|---|---|
| Molecular Weight | 343.06 g/mol |
| LogP | 4.6007 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.0587 |
| Heavy Atoms | 23 |
| Complexity | 689.46985 |
Chemical Identifiers
| CAS Number | 339010-47-8 |
|---|---|
| SMILES | CC(C1=C(C=C(C=N1)C(F)(F)F)Cl)C(=O)OCC2=CC=CC=C2 |
Product Overview
Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate (CAS 339010-47-8), with molecular formula C16H13ClF3NO2 and molecular weight 343.06 g/mol. IUPAC: benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate.
Chemical Property Profile of Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate
Property Insights of Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate
The XLogP value of 4.6007 indicates that Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.19 Ų, Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate 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 Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate?
The CAS number of Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate is 339010-47-8.
What is the molecular formula of Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate?
The molecular formula of Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate is C16H13ClF3NO2.
What is the molecular weight of Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate?
The molecular weight of Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate is 343.06 g/mol.
Where can I buy Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate?
You can request a quote for Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.