Dipropyl heptanedioate
TL;DR: Dipropyl heptanedioate (CAS 51238-92-7) 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.
dipropyl heptanedioate
Also Known As: dipropyl heptanedioate, dipropyl pimelate, Pimelic acid dipropyl ester, Pimelinsaure-n-dipropylester, heptanedioic acid dipropyl ester
| Molecular Formula | C13H24O4 |
|---|---|
| Molecular Weight | 244.17 g/mol |
| LogP | 2.9 |
| 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 | 51238-92-7 |
|---|---|
| SMILES | CCCOC(=O)CCCCCC(=O)OCCC |
| InChIKey | PKQHRIXOXXYVJL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dipropyl heptanedioate (CAS 51238-92-7), with molecular formula C13H24O4 and molecular weight 244.17 g/mol. IUPAC: dipropyl heptanedioate.
Chemical Property Profile of Dipropyl heptanedioate
Property Insights of Dipropyl heptanedioate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dipropyl heptanedioate. With a topological polar surface area (TPSA) of 52.6 Ų, Dipropyl heptanedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dipropyl heptanedioate 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 Dipropyl heptanedioate?
The CAS number of Dipropyl heptanedioate is 51238-92-7.
What is the molecular formula of Dipropyl heptanedioate?
The molecular formula of Dipropyl heptanedioate is C13H24O4.
What is the molecular weight of Dipropyl heptanedioate?
The molecular weight of Dipropyl heptanedioate is 244.17 g/mol.
Where can I buy Dipropyl heptanedioate?
You can request a quote for Dipropyl heptanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dipropyl heptanedioate?
Yes, KEHONG BIO provides custom synthesis services for Dipropyl heptanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.