Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)-
TL;DR: Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)- (CAS 1229-52-3) 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-(butanoylamino)-2,4,6-triiodophenoxy]propanoic acid
Also Known As: 2-(3-Butyramido-2,4,6-triiodophenoxy)propionic acid, Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)-, 2-[3-(butanoylamino)-2,4,6-triiodophenoxy]propanoic acid, 2-(3-butanamido-2,4,6-triiodophenoxy)propanoic acid, alpha-(2,4,6-Trijod-3(n)-butyrylamino-phenoxy)-propionsaeure
| Molecular Formula | C13H14I3NO4 |
|---|---|
| Molecular Weight | 628.81 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 628.8057 |
| Heavy Atoms | 21 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 1229-52-3 |
|---|---|
| SMILES | CCCC(=O)NC1=C(C(=C(C=C1I)I)OC(C)C(=O)O)I |
| InChIKey | GMEADEZQYNIZFO-UHFFFAOYSA-N |
Product Overview
Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)- (CAS 1229-52-3), with molecular formula C13H14I3NO4 and molecular weight 628.81 g/mol. IUPAC: 2-[3-(butanoylamino)-2,4,6-triiodophenoxy]propanoic acid.
Chemical Property Profile of Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)-
Property Insights of Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)-
The XLogP value of 3.8 indicates that Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)-. Following Lipinski's Rule of Five, Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)- has 2 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 Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)-?
The CAS number of Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)- is 1229-52-3.
What is the molecular formula of Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)-?
The molecular formula of Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)- is C13H14I3NO4.
What is the molecular weight of Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)-?
The molecular weight of Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)- is 628.81 g/mol.
Where can I buy Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)-?
You can request a quote for Propionic acid, 2-(3-butyramido-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 Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.