![Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate structure](/static/products/943/94313-92-5.png)
Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate
TL;DR: Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate (CAS 94313-92-5) is a chemical compound with molecular formula C48H86O10 and molecular weight 822.62 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-hydroxy-3-octadec-9-enoyloxypropyl) hexanedioate
Also Known As: bis[2-hydroxy-3-[oxy]propyl]adipate, Bis[2-hydroxy-3-[(1-oxooctadec-9-enyl)oxy]propyl]adipate, Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate, BIS[2-HYDROXY-3-[(1-OXOOCTADEC-9-ENYL)OXY]PROPYL] ADIPATE, 1,6-Bis[2-hydroxy-3-[(1-oxo-9-octadecen-1-yl)oxy]propyl] hexanedioate
| Molecular Formula | C48H86O10 |
|---|---|
| Molecular Weight | 822.62 g/mol |
| LogP | 11.5164 |
| Topological Polar Surface Area | 145.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 43 |
| Exact Mass | 822.6221 |
| Heavy Atoms | 58 |
| Complexity | 945.97394 |
Chemical Identifiers
| CAS Number | 94313-92-5 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCC(=O)OCC(COC(=O)CCCCCCCC=CCCCCCCCC)O)O |
Product Overview
Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate (CAS 94313-92-5), with molecular formula C48H86O10 and molecular weight 822.62 g/mol. IUPAC: bis(2-hydroxy-3-octadec-9-enoyloxypropyl) hexanedioate.
Chemical Property Profile of Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate
Property Insights of Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate
The XLogP value of 11.5164 indicates that Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 145.66 Ų indicates high polarity, suggesting Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate?
The CAS number of Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate is 94313-92-5.
What is the molecular formula of Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate?
The molecular formula of Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate is C48H86O10.
What is the molecular weight of Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate?
The molecular weight of Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate is 822.62 g/mol.
Where can I buy Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate?
You can request a quote for Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate?
Yes, KEHONG BIO provides custom synthesis services for Bis{2-hydroxy-3-[(octadec-9-enoyl)oxy]propyl} hexanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.