Dihexyl Adipate
TL;DR: Dihexyl Adipate (CAS 110-33-8) 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.
dihexyl hexanedioate
Also Known As: DIHEXYL ADIPATE, Dihexyl hexanedioate, Di-n-hexyl adipate, Dihexyladipate, Adipic acid, dihexyl ester
| Molecular Formula | C18H34O4 |
|---|---|
| Molecular Weight | 314.25 g/mol |
| LogP | 5.3 |
| 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 |
| Density | 0.939 at 20.0 °C - Less dense than water; will float |
| Flash Point | 162.8 °C |
Chemical Identifiers
| CAS Number | 110-33-8 |
|---|---|
| SMILES | CCCCCCOC(=O)CCCCC(=O)OCCCCCC |
| InChIKey | HHECSPXBQJHZAF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dihexyl Adipate (CAS 110-33-8), with molecular formula C18H34O4 and molecular weight 314.25 g/mol. IUPAC: dihexyl hexanedioate.
Chemical Property Profile of Dihexyl Adipate
Property Insights of Dihexyl Adipate
The XLogP value of 5.3 indicates that Dihexyl Adipate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Dihexyl Adipate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dihexyl Adipate 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 Dihexyl Adipate?
The CAS number of Dihexyl Adipate is 110-33-8.
What is the molecular formula of Dihexyl Adipate?
The molecular formula of Dihexyl Adipate is C18H34O4.
What is the molecular weight of Dihexyl Adipate?
The molecular weight of Dihexyl Adipate is 314.25 g/mol.
Where can I buy Dihexyl Adipate?
You can request a quote for Dihexyl Adipate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihexyl Adipate?
Yes, KEHONG BIO provides custom synthesis services for Dihexyl Adipate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.