Diisobutyl 3,9-perylenedicarboxylate
TL;DR: Diisobutyl 3,9-perylenedicarboxylate (CAS 2744-50-5) is a chemical compound with molecular formula C30H28O4 and molecular weight 452.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-methylpropyl) perylene-3,9-dicarboxylate
Also Known As: diisobutyl perylene-3,9-dicarboxylate, Solvent Green 5, Diisobutyl 3,9-perylenedicarboxylate, Fluorescent yellow 8g, fluorol green gold 084
| Molecular Formula | C30H28O4 |
|---|---|
| Molecular Weight | 452.20 g/mol |
| LogP | 8.1 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 452.19876 |
| Heavy Atoms | 34 |
| Complexity | 682.0 |
Chemical Identifiers
| CAS Number | 2744-50-5 |
|---|---|
| SMILES | CC(C)COC(=O)C1=CC=C2C3=C4C(=CC=C3)C(=CC=C4C5=C2C1=CC=C5)C(=O)OCC(C)C |
| InChIKey | YLNJGHNUXCVDIX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diisobutyl 3,9-perylenedicarboxylate (CAS 2744-50-5), with molecular formula C30H28O4 and molecular weight 452.20 g/mol. IUPAC: bis(2-methylpropyl) perylene-3,9-dicarboxylate.
Chemical Property Profile of Diisobutyl 3,9-perylenedicarboxylate
Property Insights of Diisobutyl 3,9-perylenedicarboxylate
The XLogP value of 8.1 indicates that Diisobutyl 3,9-perylenedicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Diisobutyl 3,9-perylenedicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diisobutyl 3,9-perylenedicarboxylate 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 Diisobutyl 3,9-perylenedicarboxylate?
The CAS number of Diisobutyl 3,9-perylenedicarboxylate is 2744-50-5.
What is the molecular formula of Diisobutyl 3,9-perylenedicarboxylate?
The molecular formula of Diisobutyl 3,9-perylenedicarboxylate is C30H28O4.
What is the molecular weight of Diisobutyl 3,9-perylenedicarboxylate?
The molecular weight of Diisobutyl 3,9-perylenedicarboxylate is 452.20 g/mol.
Where can I buy Diisobutyl 3,9-perylenedicarboxylate?
You can request a quote for Diisobutyl 3,9-perylenedicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diisobutyl 3,9-perylenedicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diisobutyl 3,9-perylenedicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.