Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate
TL;DR: Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate (CAS 6417-43-2) is a chemical compound with molecular formula C12H16Cl3NO5 and molecular weight 359.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-hydroxyethylamino)ethanol;2-(2,4,5-trichlorophenoxy)acetic acid
Also Known As: bis ammonium2,4,5-trichlorophenoxyacetate, Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate, 2-(2-hydroxyethylamino)ethanol; 2-(2,4,5-trichlorophenoxy)acetic acid, 2-hydroxy-n-(2-hydroxyethyl)ethanaminium(2,4,5-trichlorophenoxy)acetate, (2,4,5-Trichlorophenoxy)acetic acid--2,2'-azanediyldi(ethan-1-ol) (1/1)
| Molecular Formula | C12H16Cl3NO5 |
|---|---|
| Molecular Weight | 359.01 g/mol |
| LogP | 1.67 |
| Topological Polar Surface Area | 99.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 359.0094 |
| Heavy Atoms | 21 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 6417-43-2 |
|---|---|
| SMILES | C1=C(C(=CC(=C1Cl)Cl)Cl)OCC(=O)O.C(CO)NCCO |
| InChIKey | QKBDWMJBSCEOOL-UHFFFAOYSA-N |
Product Overview
Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate (CAS 6417-43-2), with molecular formula C12H16Cl3NO5 and molecular weight 359.01 g/mol. IUPAC: 2-(2-hydroxyethylamino)ethanol;2-(2,4,5-trichlorophenoxy)acetic acid.
Chemical Property Profile of Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate
Property Insights of Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate
The XLogP value of 1.67 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate. The TPSA of 99.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate. Following Lipinski's Rule of Five, Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate 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 Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate?
The CAS number of Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate is 6417-43-2.
What is the molecular formula of Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate?
The molecular formula of Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate is C12H16Cl3NO5.
What is the molecular weight of Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate?
The molecular weight of Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate is 359.01 g/mol.
Where can I buy Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate?
You can request a quote for Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate?
Yes, KEHONG BIO provides custom synthesis services for Bis(2-hydroxyethyl)ammonium 2,4,5-trichlorophenoxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.