3-(2-Chlorophenoxy)propionic acid
TL;DR: 3-(2-Chlorophenoxy)propionic acid (CAS 7170-45-8) is a chemical compound with molecular formula C9H9ClO3 and molecular weight 200.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorophenoxy)propanoic acid
Also Known As: 3-(2-chlorophenoxy)propanoic acid, 3-(2-Chlorophenoxy)propionic acid, 3-(2-chlorophenoxy)propanoicacid, 2-(o-Chlorophenoxy)propionic acid, 2-(2-Chlorophenoxy)propanoic acid
| Molecular Formula | C9H9ClO3 |
|---|---|
| Molecular Weight | 200.02 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 200.02402 |
| Heavy Atoms | 13 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 7170-45-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)OCCC(=O)O)Cl |
| InChIKey | UZFYWLRSVDZCSF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(2-Chlorophenoxy)propionic acid (CAS 7170-45-8), with molecular formula C9H9ClO3 and molecular weight 200.02 g/mol. IUPAC: 3-(2-chlorophenoxy)propanoic acid.
Chemical Property Profile of 3-(2-Chlorophenoxy)propionic acid
Property Insights of 3-(2-Chlorophenoxy)propionic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Chlorophenoxy)propionic acid. With a topological polar surface area (TPSA) of 46.5 Ų, 3-(2-Chlorophenoxy)propionic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Chlorophenoxy)propionic 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 3-(2-Chlorophenoxy)propionic acid?
The CAS number of 3-(2-Chlorophenoxy)propionic acid is 7170-45-8.
What is the molecular formula of 3-(2-Chlorophenoxy)propionic acid?
The molecular formula of 3-(2-Chlorophenoxy)propionic acid is C9H9ClO3.
What is the molecular weight of 3-(2-Chlorophenoxy)propionic acid?
The molecular weight of 3-(2-Chlorophenoxy)propionic acid is 200.02 g/mol.
Where can I buy 3-(2-Chlorophenoxy)propionic acid?
You can request a quote for 3-(2-Chlorophenoxy)propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Chlorophenoxy)propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Chlorophenoxy)propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.