Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)-
TL;DR: Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)- (CAS 13080-23-4) is a chemical compound with molecular formula C13H14I3NO4 and molecular weight 628.81 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenoxy]butanoic acid
Also Known As: 2-(3-(N-Methylacetamido)-2,4,6-triiodophenoxy)butyric acid, 2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenoxy]butanoic acid, 2-[3-(N-Methylacetylamino)-2,4,6-triiodophenoxy]butyric acid, BUTYRIC ACID, 2-(3-(N-METHYLACETAMIDO)-2,4,6-TRIIODOPHENOXY)-, 2-[2,4,6-triiodo-3-(N-methylacetamido)phenoxy]butanoic acid
| Molecular Formula | C13H14I3NO4 |
|---|---|
| Molecular Weight | 628.81 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 628.8057 |
| Heavy Atoms | 21 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 13080-23-4 |
|---|---|
| SMILES | CCC(C(=O)O)OC1=C(C=C(C(=C1I)N(C)C(=O)C)I)I |
| InChIKey | SEPSYIXFWLWAQJ-UHFFFAOYSA-N |
Product Overview
Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)- (CAS 13080-23-4), with molecular formula C13H14I3NO4 and molecular weight 628.81 g/mol. IUPAC: 2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenoxy]butanoic acid.
Chemical Property Profile of Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)-
Property Insights of Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)-
The XLogP value of 3.7 indicates that Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)-. Following Lipinski's Rule of Five, Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)-?
The CAS number of Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)- is 13080-23-4.
What is the molecular formula of Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)-?
The molecular formula of Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)- is C13H14I3NO4.
What is the molecular weight of Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)-?
The molecular weight of Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)- is 628.81 g/mol.
Where can I buy Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)-?
You can request a quote for Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Butyric acid, 2-(3-(N-methylacetamido)-2,4,6-triiodophenoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.