Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo-
TL;DR: Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo- (CAS 51134-94-2) is a chemical compound with molecular formula C23H20I6N2O8 and molecular weight 1213.55 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-[3-[3-(3-carboxy-2,4,6-triiodoanilino)-3-oxopropoxy]propoxy]propanoylamino]-2,4,6-triiodobenzoic acid
Also Known As: BENZOIC ACID, 3,3'-(TRIMETHYLENEBIS(OXYETHYLENECARBONYLIMINO))BIS(2,4,6-TRIIODO-, 3,3'-(Trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodobenzoic acid), 3,3'-{Propane-1,3-diylbis[oxy(1-oxopropane-3,1-diyl)azanediyl]}bis(2,4,6-triiodobenzoic acid), 3-[3-[3-[3-(3-carboxy-2,4,6-triiodoanilino)-3-oxopropoxy]propoxy]propanoylamino]-2,4,6-triiodobenzoic acid, BRN 2800019
| Molecular Formula | C23H20I6N2O8 |
|---|---|
| Molecular Weight | 1213.55 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 151.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 14 |
| Exact Mass | 1213.5488 |
| Heavy Atoms | 39 |
| Complexity | 791.0 |
Chemical Identifiers
| CAS Number | 51134-94-2 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1I)NC(=O)CCOCCCOCCC(=O)NC2=C(C=C(C(=C2I)C(=O)O)I)I)I)C(=O)O)I |
| InChIKey | XAEFFXGVTYPNID-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo- (CAS 51134-94-2), with molecular formula C23H20I6N2O8 and molecular weight 1213.55 g/mol. IUPAC: 3-[3-[3-[3-(3-carboxy-2,4,6-triiodoanilino)-3-oxopropoxy]propoxy]propanoylamino]-2,4,6-triiodobenzoic acid.
Chemical Property Profile of Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo-
Property Insights of Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo-
The XLogP value of 4.9 indicates that Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 151.0 Ų indicates high polarity, suggesting Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo- has 4 hydrogen bond donor(s) and 8 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, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo-?
The CAS number of Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo- is 51134-94-2.
What is the molecular formula of Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo-?
The molecular formula of Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo- is C23H20I6N2O8.
What is the molecular weight of Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo-?
The molecular weight of Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo- is 1213.55 g/mol.
Where can I buy Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo-?
You can request a quote for Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.