3-(2,4,5-三氯苯氧基)丙酸
TL;DR: 3-(2,4,5-三氯苯氧基)丙酸 (CAS 582-53-6) is a chemical compound with molecular formula C9H7Cl3O3 and molecular weight 267.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,4,5-三氯苯氧基)丙酸
3-(2,4,5-trichlorophenoxy)propanoic acid
Also Known As: 3-(2,4,5-trichlorophenoxy)propanoic acid, 2,4,5-Trichlorophenoxypropanoic acid, 2,4-,5-trichlorophenoxypropionic acid, Propionic acid, (2,4,5-trichlorophenoxy)-, 3-(2,4,5-trichlorophenoxy)propanoicacid
| Molecular Formula | C9H7Cl3O3 |
|---|---|
| Molecular Weight | 267.95 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 267.94608 |
| Heavy Atoms | 15 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 582-53-6 |
|---|---|
| SMILES | C1=C(C(=CC(=C1Cl)Cl)Cl)OCCC(=O)O |
| InChIKey | TZMWJEKNHBCUKP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(2,4,5-三氯苯氧基)丙酸 (CAS 582-53-6), with molecular formula C9H7Cl3O3 and molecular weight 267.95 g/mol. IUPAC: 3-(2,4,5-trichlorophenoxy)propanoic acid.
Chemical Property Profile of 3-(2,4,5-三氯苯氧基)丙酸
Property Insights of 3-(2,4,5-三氯苯氧基)丙酸
The XLogP value of 3.3 indicates that 3-(2,4,5-三氯苯氧基)丙酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 3-(2,4,5-三氯苯氧基)丙酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,4,5-三氯苯氧基)丙酸 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-(2,4,5-三氯苯氧基)丙酸?
The CAS number of 3-(2,4,5-三氯苯氧基)丙酸 is 582-53-6.
What is the molecular formula of 3-(2,4,5-三氯苯氧基)丙酸?
The molecular formula of 3-(2,4,5-三氯苯氧基)丙酸 is C9H7Cl3O3.
What is the molecular weight of 3-(2,4,5-三氯苯氧基)丙酸?
The molecular weight of 3-(2,4,5-三氯苯氧基)丙酸 is 267.95 g/mol.
Where can I buy 3-(2,4,5-三氯苯氧基)丙酸?
You can request a quote for 3-(2,4,5-三氯苯氧基)丙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,4,5-三氯苯氧基)丙酸?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,4,5-三氯苯氧基)丙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.