Cambridge id 5489524
TL;DR: Cambridge id 5489524 (CAS 42459-68-7) is a chemical compound with molecular formula C15H24ClNO6 and molecular weight 349.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-2-methylphenoxy)acetate;tris(2-hydroxyethyl)azanium
Also Known As: tris ammonium4-chloro-o-tolyloxyacetate, tris(2-hydroxyethyl)ammonium 4-chloro-2-methylphenoxyacetate, 2-(4-chloro-2-methylphenoxy)acetate; tris(2-hydroxyethyl)azanium, IUPAC: 2-(4-chloro-2-methyl-phenoxy)acetate; Tris(2-hydroxyethyl)azanium, Cambridge id 5489524
| Molecular Formula | C15H24ClNO6 |
|---|---|
| Molecular Weight | 349.13 g/mol |
| LogP | -2.37468 |
| Topological Polar Surface Area | 114.49 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 349.1292 |
| Heavy Atoms | 23 |
| Complexity | 443.3286 |
Chemical Identifiers
| CAS Number | 42459-68-7 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)OCC(=O)[O-].C(CO)[NH+](CCO)CCO |
Product Overview
Cambridge id 5489524 (CAS 42459-68-7), with molecular formula C15H24ClNO6 and molecular weight 349.13 g/mol. IUPAC: 2-(4-chloro-2-methylphenoxy)acetate;tris(2-hydroxyethyl)azanium.
Chemical Property Profile of Cambridge id 5489524
Property Insights of Cambridge id 5489524
The XLogP value of -2.37468 indicates that Cambridge id 5489524 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 114.49 Ų falls within the moderate polarity range, balancing permeability and solubility for Cambridge id 5489524. Following Lipinski's Rule of Five, Cambridge id 5489524 has 4 hydrogen bond donor(s) and 6 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 Cambridge id 5489524?
The CAS number of Cambridge id 5489524 is 42459-68-7.
What is the molecular formula of Cambridge id 5489524?
The molecular formula of Cambridge id 5489524 is C15H24ClNO6.
What is the molecular weight of Cambridge id 5489524?
The molecular weight of Cambridge id 5489524 is 349.13 g/mol.
Where can I buy Cambridge id 5489524?
You can request a quote for Cambridge id 5489524 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cambridge id 5489524?
Yes, KEHONG BIO provides custom synthesis services for Cambridge id 5489524 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.