Nonanedioic acid, 1,9-didecyl ester
TL;DR: Nonanedioic acid, 1,9-didecyl ester (CAS 2131-27-3) is a chemical compound with molecular formula C29H56O4 and molecular weight 468.42 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
didecyl nonanedioate
Also Known As: Didecyl azelate, Didecyl nonanedioate, didecyl azelaate, Nonanedioic acid, didecyl ester, Azelainsaeure-didecylester
| Molecular Formula | C29H56O4 |
|---|---|
| Molecular Weight | 468.42 g/mol |
| LogP | 11.2 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 28 |
| Exact Mass | 468.41785 |
| Heavy Atoms | 33 |
| Complexity | 384.0 |
Chemical Identifiers
| CAS Number | 2131-27-3 |
|---|---|
| SMILES | CCCCCCCCCCOC(=O)CCCCCCCC(=O)OCCCCCCCCCC |
| InChIKey | WMDDQWGAOSOSAB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nonanedioic acid, 1,9-didecyl ester (CAS 2131-27-3), with molecular formula C29H56O4 and molecular weight 468.42 g/mol. IUPAC: didecyl nonanedioate.
Chemical Property Profile of Nonanedioic acid, 1,9-didecyl ester
Property Insights of Nonanedioic acid, 1,9-didecyl ester
The XLogP value of 11.2 indicates that Nonanedioic acid, 1,9-didecyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Nonanedioic acid, 1,9-didecyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nonanedioic acid, 1,9-didecyl ester 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 Nonanedioic acid, 1,9-didecyl ester?
The CAS number of Nonanedioic acid, 1,9-didecyl ester is 2131-27-3.
What is the molecular formula of Nonanedioic acid, 1,9-didecyl ester?
The molecular formula of Nonanedioic acid, 1,9-didecyl ester is C29H56O4.
What is the molecular weight of Nonanedioic acid, 1,9-didecyl ester?
The molecular weight of Nonanedioic acid, 1,9-didecyl ester is 468.42 g/mol.
Where can I buy Nonanedioic acid, 1,9-didecyl ester?
You can request a quote for Nonanedioic acid, 1,9-didecyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nonanedioic acid, 1,9-didecyl ester?
Yes, KEHONG BIO provides custom synthesis services for Nonanedioic acid, 1,9-didecyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.