decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate
TL;DR: decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate (CAS 331830-65-0) is a chemical compound with molecular formula C20H23Cl4NO4 and molecular weight 481.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
decyl 2-(4,5,6,7-tetrachloro-1,3-dioxoisoindol-2-yl)acetate
Also Known As: BAS 00604317, decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate, decyl 2-(4,5,6,7-tetrachloro-1,3-dioxoisoindol-2-yl)acetate, decyl 2-(4,5,6,7-tetrachloro-1,3-dioxobenzo[c]azolin-2-yl)acetate, (4,5,6,7-TETRACHLORO-1,3-DIOXO-1,3-2H-ISOINDOL-2-YL)-ACETIC ACID DECYL ESTER
| Molecular Formula | C20H23Cl4NO4 |
|---|---|
| Molecular Weight | 481.04 g/mol |
| LogP | 6.5801 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 481.03812 |
| Heavy Atoms | 29 |
| Complexity | 750.42126 |
Chemical Identifiers
| CAS Number | 331830-65-0 |
|---|---|
| SMILES | CCCCCCCCCCOC(=O)CN1C(=O)C2=C(C1=O)C(=C(C(=C2Cl)Cl)Cl)Cl |
Product Overview
decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate (CAS 331830-65-0), with molecular formula C20H23Cl4NO4 and molecular weight 481.04 g/mol. IUPAC: decyl 2-(4,5,6,7-tetrachloro-1,3-dioxoisoindol-2-yl)acetate.
Chemical Property Profile of decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate
Property Insights of decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate
The XLogP value of 6.5801 indicates that decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate. Following Lipinski's Rule of Five, decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate?
The CAS number of decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate is 331830-65-0.
What is the molecular formula of decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate?
The molecular formula of decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate is C20H23Cl4NO4.
What is the molecular weight of decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate?
The molecular weight of decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate is 481.04 g/mol.
Where can I buy decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate?
You can request a quote for decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for decyl (4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.