![2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid structure](/static/products/3525/352536-52-8.webp)
2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid
TL;DR: 2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid (CAS 352536-52-8) is a chemical compound with molecular formula C14H11Cl4NO3 and molecular weight 380.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(prop-2-enyl)carbamoyl]-3,4,5,6-tetrachlorobenzoic acid
Also Known As: AB00078445-01, 2,3,4,5-tetrachloro-6-(diallylcarbamoyl)benzoic acid, 2,3,4,5-tetrachloro-6-[(diallylamino)carbonyl]benzoic acid, 2-[bis(prop-2-enyl)carbamoyl]-3,4,5,6-tetrachlorobenzoic acid
| Molecular Formula | C14H11Cl4NO3 |
|---|---|
| Molecular Weight | 380.95 g/mol |
| LogP | 4.8126 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 380.9493 |
| Heavy Atoms | 22 |
| Complexity | 648.2234 |
Chemical Identifiers
| CAS Number | 352536-52-8 |
|---|---|
| SMILES | C=CCN(CC=C)C(=O)C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)O |
Product Overview
2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid (CAS 352536-52-8), with molecular formula C14H11Cl4NO3 and molecular weight 380.95 g/mol. IUPAC: 2-[bis(prop-2-enyl)carbamoyl]-3,4,5,6-tetrachlorobenzoic acid.
Chemical Property Profile of 2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid
Property Insights of 2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid
The XLogP value of 4.8126 indicates that 2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.61 Ų, 2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid?
The CAS number of 2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid is 352536-52-8.
What is the molecular formula of 2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid?
The molecular formula of 2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid is C14H11Cl4NO3.
What is the molecular weight of 2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid?
The molecular weight of 2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid is 380.95 g/mol.
Where can I buy 2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid?
You can request a quote for 2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4,5-Tetrachloro-6-[(diallylamino)carbonyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.