1,4-Dioctadecyl (2Z)-2-butenedioate
TL;DR: 1,4-Dioctadecyl (2Z)-2-butenedioate (CAS 7516-70-3) is a chemical compound with molecular formula C40H76O4 and molecular weight 620.57 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dioctadecyl (Z)-but-2-enedioate
Also Known As: Distearyl maleate, Dioctadecyl maleate, octadecylhydromaleate, di(octadecyl) maleate, Maleic acid, dioctadecyl ester
| Molecular Formula | C40H76O4 |
|---|---|
| Molecular Weight | 620.57 g/mol |
| LogP | 13.152 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 36 |
| Exact Mass | 620.57434 |
| Heavy Atoms | 44 |
| Complexity | 562.49744 |
Chemical Identifiers
| CAS Number | 7516-70-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCOC(=O)/C=C\C(=O)OCCCCCCCCCCCCCCCCCC |
Product Overview
1,4-Dioctadecyl (2Z)-2-butenedioate (CAS 7516-70-3), with molecular formula C40H76O4 and molecular weight 620.57 g/mol. IUPAC: dioctadecyl (Z)-but-2-enedioate.
Chemical Property Profile of 1,4-Dioctadecyl (2Z)-2-butenedioate
Property Insights of 1,4-Dioctadecyl (2Z)-2-butenedioate
The XLogP value of 13.152 indicates that 1,4-Dioctadecyl (2Z)-2-butenedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 1,4-Dioctadecyl (2Z)-2-butenedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dioctadecyl (2Z)-2-butenedioate 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 1,4-Dioctadecyl (2Z)-2-butenedioate?
The CAS number of 1,4-Dioctadecyl (2Z)-2-butenedioate is 7516-70-3.
What is the molecular formula of 1,4-Dioctadecyl (2Z)-2-butenedioate?
The molecular formula of 1,4-Dioctadecyl (2Z)-2-butenedioate is C40H76O4.
What is the molecular weight of 1,4-Dioctadecyl (2Z)-2-butenedioate?
The molecular weight of 1,4-Dioctadecyl (2Z)-2-butenedioate is 620.57 g/mol.
Where can I buy 1,4-Dioctadecyl (2Z)-2-butenedioate?
You can request a quote for 1,4-Dioctadecyl (2Z)-2-butenedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dioctadecyl (2Z)-2-butenedioate?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dioctadecyl (2Z)-2-butenedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.