Propanedioic acid, dipentyl ester
TL;DR: Propanedioic acid, dipentyl ester (CAS 20602-31-7) is a chemical compound with molecular formula C13H24O4 and molecular weight 244.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipentyl propanedioate
Also Known As: Diamylmalonat, dipentyl propanedioate, Propanedioic acid, dipentyl ester, Malonsaeure-dipentylester, Malonic acid dipentyl ester
| Molecular Formula | C13H24O4 |
|---|---|
| Molecular Weight | 244.17 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 244.16747 |
| Heavy Atoms | 17 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 20602-31-7 |
|---|---|
| SMILES | CCCCCOC(=O)CC(=O)OCCCCC |
| InChIKey | MOJJCFBDUWMVJK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propanedioic acid, dipentyl ester (CAS 20602-31-7), with molecular formula C13H24O4 and molecular weight 244.17 g/mol. IUPAC: dipentyl propanedioate.
Chemical Property Profile of Propanedioic acid, dipentyl ester
Property Insights of Propanedioic acid, dipentyl ester
The XLogP value of 3.7 indicates that Propanedioic acid, dipentyl 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, Propanedioic acid, dipentyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanedioic acid, dipentyl ester has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Propanedioic acid, dipentyl ester?
The CAS number of Propanedioic acid, dipentyl ester is 20602-31-7.
What is the molecular formula of Propanedioic acid, dipentyl ester?
The molecular formula of Propanedioic acid, dipentyl ester is C13H24O4.
What is the molecular weight of Propanedioic acid, dipentyl ester?
The molecular weight of Propanedioic acid, dipentyl ester is 244.17 g/mol.
Where can I buy Propanedioic acid, dipentyl ester?
You can request a quote for Propanedioic acid, dipentyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanedioic acid, dipentyl ester?
Yes, KEHONG BIO provides custom synthesis services for Propanedioic acid, dipentyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.