Ditridecyl but-2-enedioate
TL;DR: Ditridecyl but-2-enedioate (CAS 61791-92-2) 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 but-2-enedioate
Also Known As: ditridecyl but-2-enedioate, 2-Butenedioic acid (2E)-, ditridecyl ester, 2-Butenedioic acid (2E)-, 1,4-ditridecyl ester, 2-Butenedioic acid(2E)-, 1,4-ditridecyl ester
| Molecular Formula | C30H56O4 |
|---|---|
| Molecular Weight | 480.42 g/mol |
| LogP | 12.5 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 28 |
| Exact Mass | 480.41785 |
| Heavy Atoms | 34 |
| Complexity | 430.0 |
Chemical Identifiers
| CAS Number | 61791-92-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCOC(=O)C=CC(=O)OCCCCCCCCCCCCC |
| InChIKey | DFKBFBPHOGVNGQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ditridecyl but-2-enedioate (CAS 61791-92-2), with molecular formula C30H56O4 and molecular weight 480.42 g/mol. IUPAC: ditridecyl but-2-enedioate.
Chemical Property Profile of Ditridecyl but-2-enedioate
Property Insights of Ditridecyl but-2-enedioate
The XLogP value of 12.5 indicates that Ditridecyl but-2-enedioate 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 but-2-enedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ditridecyl but-2-enedioate 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 but-2-enedioate?
The CAS number of Ditridecyl but-2-enedioate is 61791-92-2.
What is the molecular formula of Ditridecyl but-2-enedioate?
The molecular formula of Ditridecyl but-2-enedioate is C30H56O4.
What is the molecular weight of Ditridecyl but-2-enedioate?
The molecular weight of Ditridecyl but-2-enedioate is 480.42 g/mol.
Where can I buy Ditridecyl but-2-enedioate?
You can request a quote for Ditridecyl but-2-enedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ditridecyl but-2-enedioate?
Yes, KEHONG BIO provides custom synthesis services for Ditridecyl but-2-enedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.