Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)-
TL;DR: Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)- (CAS 29193-34-8) is a chemical compound with molecular formula C13H14I3NO3 and molecular weight 612.81 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[acetyl(propyl)amino]-2,4,6-triiodophenyl]acetic acid
Also Known As: [2,4,6-Triiodo-3- phenyl]aceticacid|(3-(N-Propylacetamido)-2,4,6-triiodophenyl)acetic acid|ACETIC ACID, (3-(N-PROPYLACETAMIDO)-2,4,6-TRIIODOPHENYL)-|2-[3-[acetyl(propyl)amino]-2,4,6-triiodophenyl]acetic acid|[2,4,6-Triiodo-3-(N-propylacetamido)phenyl]acetic acid|[2,4,6-Triiodo-3-(N-propylacetylamino)phenyl]acetic acid|2-[2,4,6-triiodo-3-(N-propylacetamido)phenyl]acetic acid|Acetic acid, [2,4,6-triiodo-3-(N-propylacetamido)phenyl]-|BRN 3001019|RefChem:316192|DTXCID10105939
| Molecular Formula | C13H14I3NO3 |
|---|---|
| Molecular Weight | 612.81 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 612.8108 |
| Heavy Atoms | 20 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 29193-34-8 |
|---|---|
| SMILES | CCCN(C1=C(C=C(C(=C1I)CC(=O)O)I)I)C(=O)C |
| InChIKey | RZTIXZDVPRNYRH-UHFFFAOYSA-N |
Product Overview
Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)- (CAS 29193-34-8), with molecular formula C13H14I3NO3 and molecular weight 612.81 g/mol. IUPAC: 2-[3-[acetyl(propyl)amino]-2,4,6-triiodophenyl]acetic acid.
Chemical Property Profile of Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)-
Property Insights of Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)-
The XLogP value of 3.6 indicates that Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.6 Ų, Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)-?
The CAS number of Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)- is 29193-34-8.
What is the molecular formula of Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)-?
The molecular formula of Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)- is C13H14I3NO3.
What is the molecular weight of Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)-?
The molecular weight of Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)- is 612.81 g/mol.
Where can I buy Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)-?
You can request a quote for Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, (3-(N-propylacetamido)-2,4,6-triiodophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.