Decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate
TL;DR: Decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate (CAS 332400-31-4) is a chemical compound with molecular formula C25H27Cl2NO4 and molecular weight 475.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate
Also Known As: BAS 00442242, decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate, decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate, decyl 2-(3,4-dichlorophenyl)-1,3-dioxo-5-isoindolinecarboxylate, decyl 2-(3,4-dichlorophenyl)-1,3-dioxobenzo[c]azoline-5-carboxylate
| Molecular Formula | C25H27Cl2NO4 |
|---|---|
| Molecular Weight | 475.13 g/mol |
| LogP | 7.0915 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 475.1317 |
| Heavy Atoms | 32 |
| Complexity | 1005.4316 |
Chemical Identifiers
| CAS Number | 332400-31-4 |
|---|---|
| SMILES | CCCCCCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC(=C(C=C3)Cl)Cl |
Product Overview
Decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate (CAS 332400-31-4), with molecular formula C25H27Cl2NO4 and molecular weight 475.13 g/mol. IUPAC: decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate.
Chemical Property Profile of Decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate
Property Insights of Decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate
The XLogP value of 7.0915 indicates that Decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate 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 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate. Following Lipinski's Rule of Five, Decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate 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 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate?
The CAS number of Decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate is 332400-31-4.
What is the molecular formula of Decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate?
The molecular formula of Decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate is C25H27Cl2NO4.
What is the molecular weight of Decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate?
The molecular weight of Decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate is 475.13 g/mol.
Where can I buy Decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate?
You can request a quote for Decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Decyl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.