2-(4-Methoxyphenyl)-2-phenylacetic acid
TL;DR: 2-(4-Methoxyphenyl)-2-phenylacetic acid (CAS 217490-29-4) is a chemical compound with molecular formula C17H8ClF9N2O3S and molecular weight 525.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3,5-bis(trifluoromethyl)phenyl]-2-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetamide
Also Known As: 2-(4-Methoxyphenyl)-2-phenylacetic acid, 2-(Phenyl-o-tolylmethoxy)ethyldimethylamine, N1-[3,5-DI(TRIFLUOROMETHYL)PHENYL]-2-([5-CHLORO-2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]THIO)ACETAMIDE, N-[3,5-bis(trifluoromethyl)phenyl]-2-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetamide, Acetamide,N-[3,5-bis(trifluoromethyl)phenyl]-2-[[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]thio]-
| Molecular Formula | C17H8ClF9N2O3S |
|---|---|
| Molecular Weight | 525.98 g/mol |
| LogP | 7.0354 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 525.98004 |
| Heavy Atoms | 33 |
| Complexity | 1052.8629 |
Chemical Identifiers
| CAS Number | 217490-29-4 |
|---|---|
| SMILES | C1=C(C=C(C=C1C(F)(F)F)NC(=O)CSC2=C(C=C(C(=C2)Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F |
Product Overview
2-(4-Methoxyphenyl)-2-phenylacetic acid (CAS 217490-29-4), with molecular formula C17H8ClF9N2O3S and molecular weight 525.98 g/mol. IUPAC: N-[3,5-bis(trifluoromethyl)phenyl]-2-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetamide.
Chemical Property Profile of 2-(4-Methoxyphenyl)-2-phenylacetic acid
Property Insights of 2-(4-Methoxyphenyl)-2-phenylacetic acid
The XLogP value of 7.0354 indicates that 2-(4-Methoxyphenyl)-2-phenylacetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Methoxyphenyl)-2-phenylacetic acid. Following Lipinski's Rule of Five, 2-(4-Methoxyphenyl)-2-phenylacetic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(4-Methoxyphenyl)-2-phenylacetic acid?
The CAS number of 2-(4-Methoxyphenyl)-2-phenylacetic acid is 217490-29-4.
What is the molecular formula of 2-(4-Methoxyphenyl)-2-phenylacetic acid?
The molecular formula of 2-(4-Methoxyphenyl)-2-phenylacetic acid is C17H8ClF9N2O3S.
What is the molecular weight of 2-(4-Methoxyphenyl)-2-phenylacetic acid?
The molecular weight of 2-(4-Methoxyphenyl)-2-phenylacetic acid is 525.98 g/mol.
Where can I buy 2-(4-Methoxyphenyl)-2-phenylacetic acid?
You can request a quote for 2-(4-Methoxyphenyl)-2-phenylacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methoxyphenyl)-2-phenylacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methoxyphenyl)-2-phenylacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.