Bis(octadec-9-enyl) 2-hydroxybutanedioate
TL;DR: Bis(octadec-9-enyl) 2-hydroxybutanedioate (CAS 52030-95-2) is a chemical compound with molecular formula C40H74O5 and molecular weight 634.55 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(octadec-9-enyl) 2-hydroxybutanedioate
Also Known As: Dioleyl malate, bis(octadec-9-enyl) 2-hydroxybutanedioate
| Molecular Formula | C40H74O5 |
|---|---|
| Molecular Weight | 634.55 g/mol |
| LogP | 15.1 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 37 |
| Exact Mass | 634.55365 |
| Heavy Atoms | 45 |
| Complexity | 686.0 |
Chemical Identifiers
| CAS Number | 52030-95-2 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCCOC(=O)CC(C(=O)OCCCCCCCCC=CCCCCCCCC)O |
| InChIKey | MBPUYGZEDYDAHA-UHFFFAOYSA-N |
Product Overview
Bis(octadec-9-enyl) 2-hydroxybutanedioate (CAS 52030-95-2), with molecular formula C40H74O5 and molecular weight 634.55 g/mol. IUPAC: bis(octadec-9-enyl) 2-hydroxybutanedioate.
Chemical Property Profile of Bis(octadec-9-enyl) 2-hydroxybutanedioate
Property Insights of Bis(octadec-9-enyl) 2-hydroxybutanedioate
The XLogP value of 15.1 indicates that Bis(octadec-9-enyl) 2-hydroxybutanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(octadec-9-enyl) 2-hydroxybutanedioate. Following Lipinski's Rule of Five, Bis(octadec-9-enyl) 2-hydroxybutanedioate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bis(octadec-9-enyl) 2-hydroxybutanedioate?
The CAS number of Bis(octadec-9-enyl) 2-hydroxybutanedioate is 52030-95-2.
What is the molecular formula of Bis(octadec-9-enyl) 2-hydroxybutanedioate?
The molecular formula of Bis(octadec-9-enyl) 2-hydroxybutanedioate is C40H74O5.
What is the molecular weight of Bis(octadec-9-enyl) 2-hydroxybutanedioate?
The molecular weight of Bis(octadec-9-enyl) 2-hydroxybutanedioate is 634.55 g/mol.
Where can I buy Bis(octadec-9-enyl) 2-hydroxybutanedioate?
You can request a quote for Bis(octadec-9-enyl) 2-hydroxybutanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(octadec-9-enyl) 2-hydroxybutanedioate?
Yes, KEHONG BIO provides custom synthesis services for Bis(octadec-9-enyl) 2-hydroxybutanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.