2-(4-Chloro-3-methylphenoxy)propanoic acid
TL;DR: 2-(4-Chloro-3-methylphenoxy)propanoic acid (CAS 777-54-8) is a chemical compound with molecular formula C10H11ClO3 and molecular weight 214.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-3-methylphenoxy)propanoic acid
Also Known As: 2-(4-chloro-3-methylphenoxy)propanoic acid, 2- propanoicacid, 6-Amino-2-methyl-quinolin-4-ol, 2-((4-Chloro-m-tolyl)oxy)propionic acid, Propanoic acid, 2-(4-chloro-3-methylphenoxy)-
| Molecular Formula | C10H11ClO3 |
|---|---|
| Molecular Weight | 214.04 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 214.03967 |
| Heavy Atoms | 14 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 777-54-8 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OC(C)C(=O)O)Cl |
| InChIKey | DRKJHOSTQZAYFT-UHFFFAOYSA-N |
Product Overview
2-(4-Chloro-3-methylphenoxy)propanoic acid (CAS 777-54-8), with molecular formula C10H11ClO3 and molecular weight 214.04 g/mol. IUPAC: 2-(4-chloro-3-methylphenoxy)propanoic acid.
Chemical Property Profile of 2-(4-Chloro-3-methylphenoxy)propanoic acid
Property Insights of 2-(4-Chloro-3-methylphenoxy)propanoic acid
The XLogP value of 3.1 indicates that 2-(4-Chloro-3-methylphenoxy)propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 2-(4-Chloro-3-methylphenoxy)propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Chloro-3-methylphenoxy)propanoic acid has 1 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 2-(4-Chloro-3-methylphenoxy)propanoic acid?
The CAS number of 2-(4-Chloro-3-methylphenoxy)propanoic acid is 777-54-8.
What is the molecular formula of 2-(4-Chloro-3-methylphenoxy)propanoic acid?
The molecular formula of 2-(4-Chloro-3-methylphenoxy)propanoic acid is C10H11ClO3.
What is the molecular weight of 2-(4-Chloro-3-methylphenoxy)propanoic acid?
The molecular weight of 2-(4-Chloro-3-methylphenoxy)propanoic acid is 214.04 g/mol.
Where can I buy 2-(4-Chloro-3-methylphenoxy)propanoic acid?
You can request a quote for 2-(4-Chloro-3-methylphenoxy)propanoic 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-Chloro-3-methylphenoxy)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chloro-3-methylphenoxy)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.