Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]-
TL;DR: Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]- (CAS 100754-93-6) is a chemical compound with molecular formula C14H11ClFNO2 and molecular weight 279.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(2-chloro-6-fluoroanilino)phenyl]acetic acid
Also Known As: Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]-, J1.550.328I, [2-(2-Chloro-6-fluoroanilino)phenyl]acetic acid, 2-[2-(2-chloro-6-fluoroanilino)phenyl]acetic acid, 2-[(2-Chloro-6-fluorophenyl)amino]benzeneacetic acid
| Molecular Formula | C14H11ClFNO2 |
|---|---|
| Molecular Weight | 279.05 g/mol |
| LogP | 3.8498 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 279.04623 |
| Heavy Atoms | 19 |
| Complexity | 595.895 |
Chemical Identifiers
| CAS Number | 100754-93-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=CC=C2Cl)F |
Product Overview
Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]- (CAS 100754-93-6), with molecular formula C14H11ClFNO2 and molecular weight 279.05 g/mol. IUPAC: 2-[2-(2-chloro-6-fluoroanilino)phenyl]acetic acid.
Chemical Property Profile of Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]-
Property Insights of Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]-
The XLogP value of 3.8498 indicates that Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.33 Ų, Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]- has 2 hydrogen bond donor(s) and 2 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 Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]-?
The CAS number of Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]- is 100754-93-6.
What is the molecular formula of Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]-?
The molecular formula of Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]- is C14H11ClFNO2.
What is the molecular weight of Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]-?
The molecular weight of Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]- is 279.05 g/mol.
Where can I buy Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]-?
You can request a quote for Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]-?
Yes, KEHONG BIO provides custom synthesis services for Benzeneacetic acid, 2-[(2-chloro-6-fluorophenyl)amino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.