Hexadecanedioic acid, dimethyl ester
TL;DR: Hexadecanedioic acid, dimethyl ester (CAS 19102-90-0) is a chemical compound with molecular formula C18H34O4 and molecular weight 314.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl hexadecanedioate
Also Known As: Dimethyl hexadecanedioate, Dimethyl thapsate, Hexadecanedioic acid, dimethyl ester, 1,16-dimethyl hexadecanedioate, Hexadecanedioic acid, 1,16-dimethyl ester
| Molecular Formula | C18H34O4 |
|---|---|
| Molecular Weight | 314.25 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 17 |
| Exact Mass | 314.2457 |
| Heavy Atoms | 22 |
| Complexity | 248.0 |
Chemical Identifiers
| CAS Number | 19102-90-0 |
|---|---|
| SMILES | COC(=O)CCCCCCCCCCCCCCC(=O)OC |
| InChIKey | MQIZSSSBYFJIJF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexadecanedioic acid, dimethyl ester (CAS 19102-90-0), with molecular formula C18H34O4 and molecular weight 314.25 g/mol. IUPAC: dimethyl hexadecanedioate.
Chemical Property Profile of Hexadecanedioic acid, dimethyl ester
Property Insights of Hexadecanedioic acid, dimethyl ester
The XLogP value of 6.3 indicates that Hexadecanedioic acid, dimethyl 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, Hexadecanedioic acid, dimethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexadecanedioic acid, dimethyl 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 Hexadecanedioic acid, dimethyl ester?
The CAS number of Hexadecanedioic acid, dimethyl ester is 19102-90-0.
What is the molecular formula of Hexadecanedioic acid, dimethyl ester?
The molecular formula of Hexadecanedioic acid, dimethyl ester is C18H34O4.
What is the molecular weight of Hexadecanedioic acid, dimethyl ester?
The molecular weight of Hexadecanedioic acid, dimethyl ester is 314.25 g/mol.
Where can I buy Hexadecanedioic acid, dimethyl ester?
You can request a quote for Hexadecanedioic acid, dimethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexadecanedioic acid, dimethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Hexadecanedioic acid, dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.