Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester
TL;DR: Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester (CAS 68443-33-4) is a chemical compound with molecular formula C35H36O4 and molecular weight 520.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis[4-(2-phenylpropan-2-yl)phenyl] pentanedioate
Also Known As: Di(p-cumylphenyl) glutarate, bis[4- phenyl]glutarate, bis[4-(2-phenylpropan-2-yl)phenyl] pentanedioate, Bis(4-(1-methyl-1-phenylethyl)phenyl) glutarate, Pentanedioic acid, bis(4-(1-methyl-1-phenylethyl)phenyl) ester
| Molecular Formula | C35H36O4 |
|---|---|
| Molecular Weight | 520.26 g/mol |
| LogP | 8.9 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 520.26135 |
| Heavy Atoms | 39 |
| Complexity | 694.0 |
Chemical Identifiers
| CAS Number | 68443-33-4 |
|---|---|
| SMILES | CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OC(=O)CCCC(=O)OC3=CC=C(C=C3)C(C)(C)C4=CC=CC=C4 |
| InChIKey | ZZWYQFFAXIHVRM-UHFFFAOYSA-N |
Product Overview
Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester (CAS 68443-33-4), with molecular formula C35H36O4 and molecular weight 520.26 g/mol. IUPAC: bis[4-(2-phenylpropan-2-yl)phenyl] pentanedioate.
Chemical Property Profile of Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester
Property Insights of Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester
The XLogP value of 8.9 indicates that Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester 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 Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester?
The CAS number of Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester is 68443-33-4.
What is the molecular formula of Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester?
The molecular formula of Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester is C35H36O4.
What is the molecular weight of Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester?
The molecular weight of Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester is 520.26 g/mol.
Where can I buy Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester?
You can request a quote for Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester?
Yes, KEHONG BIO provides custom synthesis services for Pentanedioic acid, 1,5-bis[4-(1-methyl-1-phenylethyl)phenyl] ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.