Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo-
TL;DR: Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo- (CAS 3942-58-3) is a chemical compound with molecular formula C10H7I4NO3 and molecular weight 696.66 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(ethylcarbamoyl)-2,3,5,6-tetraiodobenzoic acid
Also Known As: Tetrajodterephthalsaure-mono-aethylamid, Tetrajodterephthalsaure-mono-aethylamid [German], 4-(ethylcarbamoyl)-2,3,5,6-tetraiodobenzoic acid, Terephthalamic acid, N-ethyl-2,3,5,6-tetraiodo, Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo-
| Molecular Formula | C10H7I4NO3 |
|---|---|
| Molecular Weight | 696.66 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 696.6605 |
| Heavy Atoms | 18 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 3942-58-3 |
|---|---|
| SMILES | CCNC(=O)C1=C(C(=C(C(=C1I)I)C(=O)O)I)I |
| InChIKey | ZMTCWFCOFLWIPI-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo- (CAS 3942-58-3), with molecular formula C10H7I4NO3 and molecular weight 696.66 g/mol. IUPAC: 4-(ethylcarbamoyl)-2,3,5,6-tetraiodobenzoic acid.
Chemical Property Profile of Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo-
Property Insights of Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo-
The XLogP value of 3.7 indicates that Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo-. Following Lipinski's Rule of Five, Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo- has 2 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 Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo-?
The CAS number of Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo- is 3942-58-3.
What is the molecular formula of Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo-?
The molecular formula of Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo- is C10H7I4NO3.
What is the molecular weight of Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo-?
The molecular weight of Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo- is 696.66 g/mol.
Where can I buy Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo-?
You can request a quote for Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4-((ethylamino)carbonyl)-2,3,5,6-tetraiodo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.