Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate
TL;DR: Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate (CAS 313962-66-2) is a chemical compound with molecular formula C23H23Cl2NO4 and molecular weight 447.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octyl 2-(2,3-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate
Also Known As: octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate, octyl 2-(2,3-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate, octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
| Molecular Formula | C23H23Cl2NO4 |
|---|---|
| Molecular Weight | 447.10 g/mol |
| LogP | 6.3113 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 447.1004 |
| Heavy Atoms | 30 |
| Complexity | 973.6706 |
Chemical Identifiers
| CAS Number | 313962-66-2 |
|---|---|
| SMILES | CCCCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=C(C(=CC=C3)Cl)Cl |
Product Overview
Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate (CAS 313962-66-2), with molecular formula C23H23Cl2NO4 and molecular weight 447.10 g/mol. IUPAC: octyl 2-(2,3-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate.
Chemical Property Profile of Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate
Property Insights of Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate
The XLogP value of 6.3113 indicates that Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate 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 Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate. Following Lipinski's Rule of Five, Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate 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 Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate?
The CAS number of Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate is 313962-66-2.
What is the molecular formula of Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate?
The molecular formula of Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate is C23H23Cl2NO4.
What is the molecular weight of Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate?
The molecular weight of Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate is 447.10 g/mol.
Where can I buy Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate?
You can request a quote for Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Octyl 2-(2,3-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.