Ditridecyl fumarate
TL;DR: Ditridecyl fumarate (CAS 6864-32-0) is a chemical compound with molecular formula C30H56O4 and molecular weight 480.42 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ditridecyl (E)-but-2-enedioate
Also Known As: DITRIDECYL FUMARATE, Ditridecyl maleate, ditridecyl (E)-but-2-enedioate, Fumaric acid ditridecyl ester, Fumaric acid, ditridecyl ester
| Molecular Formula | C30H56O4 |
|---|---|
| Molecular Weight | 480.42 g/mol |
| LogP | 9.251 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 26 |
| Exact Mass | 480.41785 |
| Heavy Atoms | 34 |
| Complexity | 430.42578 |
Chemical Identifiers
| CAS Number | 6864-32-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCOC(=O)/C=C/C(=O)OCCCCCCCCCCCCC |
Product Overview
Ditridecyl fumarate (CAS 6864-32-0), with molecular formula C30H56O4 and molecular weight 480.42 g/mol. IUPAC: ditridecyl (E)-but-2-enedioate.
Chemical Property Profile of Ditridecyl fumarate
Property Insights of Ditridecyl fumarate
The XLogP value of 9.251 indicates that Ditridecyl fumarate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Ditridecyl fumarate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ditridecyl fumarate 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 Ditridecyl fumarate?
The CAS number of Ditridecyl fumarate is 6864-32-0.
What is the molecular formula of Ditridecyl fumarate?
The molecular formula of Ditridecyl fumarate is C30H56O4.
What is the molecular weight of Ditridecyl fumarate?
The molecular weight of Ditridecyl fumarate is 480.42 g/mol.
Where can I buy Ditridecyl fumarate?
You can request a quote for Ditridecyl fumarate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ditridecyl fumarate?
Yes, KEHONG BIO provides custom synthesis services for Ditridecyl fumarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.