Benzoic acid, 3-acetamido-2,4,6-triiodo-5-valeramido-
TL;DR: Benzoic acid, 3-acetamido-2,4,6-triiodo-5-valeramido- (CAS 67011-44-3) is a chemical compound with molecular formula C14H15I3N2O4 and molecular weight 655.8166 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-acetamido-2,4,6-triiodo-5-(pentanoylamino)benzoic acid
Also Known As: 3-Acetamido-2,4,6-triiodo-5-valeramidobenzoic acid, BENZOIC ACID, 3-ACETAMIDO-2,4,6-TRIIODO-5-VALERAMIDO-, 4-14-00-01309 (Beilstein Handbook Reference), 3-acetamido-2,4,6-triiodo-5-pentanamidobenzoic acid, 3-acetamido-2,4,6-triiodo-5-(pentanoylamino)benzoic acid
Technical Specifications
| Molecular Formula | C14H15I3N2O4 |
| Molecular Weight | 655.8166 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 655.8166 Da |
| Heavy Atoms | 23 |
| Complexity | 463.0 |
| SMILES | CCCCC(=O)NC1=C(C(=C(C(=C1I)NC(=O)C)I)C(=O)O)I |
| InChIKey | BXKVPAOMAPYOFF-UHFFFAOYSA-N |
Chemical Property Profile of Benzoic acid, 3-acetamido-2,4,6-triiodo-5-valeramido-
Property Insights of Benzoic acid, 3-acetamido-2,4,6-triiodo-5-valeramido-
The XLogP value of 3.1 indicates that Benzoic acid, 3-acetamido-2,4,6-triiodo-5-valeramido- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 3-acetamido-2,4,6-triiodo-5-valeramido-. Following Lipinski's Rule of Five, Benzoic acid, 3-acetamido-2,4,6-triiodo-5-valeramido- has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Benzoic acid, 3-acetamido-2,4,6-triiodo-5-valeramido-?
The CAS number of Benzoic acid, 3-acetamido-2,4,6-triiodo-5-valeramido- is 67011-44-3.
What is the molecular formula of Benzoic acid, 3-acetamido-2,4,6-triiodo-5-valeramido-?
The molecular formula of Benzoic acid, 3-acetamido-2,4,6-triiodo-5-valeramido- is C14H15I3N2O4.
What is the molecular weight of Benzoic acid, 3-acetamido-2,4,6-triiodo-5-valeramido-?
The molecular weight of Benzoic acid, 3-acetamido-2,4,6-triiodo-5-valeramido- is 655.8166 g/mol.
Where can I buy Benzoic acid, 3-acetamido-2,4,6-triiodo-5-valeramido-?
You can request a quote for Benzoic acid, 3-acetamido-2,4,6-triiodo-5-valeramido- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoic acid, 3-acetamido-2,4,6-triiodo-5-valeramido-?
Yes, CoreyChem provides custom synthesis services for Benzoic acid, 3-acetamido-2,4,6-triiodo-5-valeramido- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.