Benzoic acid, 3-acetamido-5-acetamidomethyl-2,4,6-triiodo-, 2-hydroxyethyl ester
TL;DR: Benzoic acid, 3-acetamido-5-acetamidomethyl-2,4,6-triiodo-, 2-hydroxyethyl ester (CAS 1555-88-0) is a chemical compound with molecular formula C14H15I3N2O5 and molecular weight 671.8115 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hydroxyethyl 3-acetamido-5-(acetamidomethyl)-2,4,6-triiodobenzoate
Also Known As: B 6500, B-6500, BENZOIC ACID, 3-ACETAMIDO-5-ACETAMIDOMETHYL-2,4,6-TRIIODO-, 2-HYDROXYETHYL ESTER, 3-Acetamido-5-acetamidomethyl-2,4,6-triiodobenzoic acid 2-hydroxyethyl ester, 2-hydroxyethyl 3-acetamido-5-(acetamidomethyl)-2,4,6-triiodobenzoate
Technical Specifications
| Molecular Formula | C14H15I3N2O5 |
| Molecular Weight | 671.8115 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 671.8115 Da |
| Heavy Atoms | 24 |
| Complexity | 479.0 |
| SMILES | CC(=O)NCC1=C(C(=C(C(=C1I)NC(=O)C)I)C(=O)OCCO)I |
| InChIKey | KWBOKBIYWOZHTC-UHFFFAOYSA-N |
Chemical Property Profile of Benzoic acid, 3-acetamido-5-acetamidomethyl-2,4,6-triiodo-, 2-hydroxyethyl ester
Property Insights of Benzoic acid, 3-acetamido-5-acetamidomethyl-2,4,6-triiodo-, 2-hydroxyethyl ester
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 3-acetamido-5-acetamidomethyl-2,4,6-triiodo-, 2-hydroxyethyl ester. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 3-acetamido-5-acetamidomethyl-2,4,6-triiodo-, 2-hydroxyethyl ester. Following Lipinski's Rule of Five, Benzoic acid, 3-acetamido-5-acetamidomethyl-2,4,6-triiodo-, 2-hydroxyethyl ester has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Benzoic acid, 3-acetamido-5-acetamidomethyl-2,4,6-triiodo-, 2-hydroxyethyl ester?
The CAS number of Benzoic acid, 3-acetamido-5-acetamidomethyl-2,4,6-triiodo-, 2-hydroxyethyl ester is 1555-88-0.
What is the molecular formula of Benzoic acid, 3-acetamido-5-acetamidomethyl-2,4,6-triiodo-, 2-hydroxyethyl ester?
The molecular formula of Benzoic acid, 3-acetamido-5-acetamidomethyl-2,4,6-triiodo-, 2-hydroxyethyl ester is C14H15I3N2O5.
What is the molecular weight of Benzoic acid, 3-acetamido-5-acetamidomethyl-2,4,6-triiodo-, 2-hydroxyethyl ester?
The molecular weight of Benzoic acid, 3-acetamido-5-acetamidomethyl-2,4,6-triiodo-, 2-hydroxyethyl ester is 671.8115 g/mol.
Where can I buy Benzoic acid, 3-acetamido-5-acetamidomethyl-2,4,6-triiodo-, 2-hydroxyethyl ester?
You can request a quote for Benzoic acid, 3-acetamido-5-acetamidomethyl-2,4,6-triiodo-, 2-hydroxyethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoic acid, 3-acetamido-5-acetamidomethyl-2,4,6-triiodo-, 2-hydroxyethyl ester?
Yes, CoreyChem provides custom synthesis services for Benzoic acid, 3-acetamido-5-acetamidomethyl-2,4,6-triiodo-, 2-hydroxyethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.