Dodecyl hydrogen adipate
TL;DR: Dodecyl hydrogen adipate (CAS 78196-50-6) 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.
6-dodecoxy-6-oxohexanoic acid
Also Known As: Dodecyl hydrogen adipate, EINECS 278-867-1, 6-dodecoxy-6-oxohexanoic acid, 6-(Dodecyloxy)-6-oxohexanoic acid, 6-dodecoxy-6-oxo-hexanoic Acid
| Molecular Formula | C18H34O4 |
|---|---|
| Molecular Weight | 314.25 g/mol |
| LogP | 5.0955 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 16 |
| Exact Mass | 314.2457 |
| Heavy Atoms | 22 |
| Complexity | 276.2607 |
Chemical Identifiers
| CAS Number | 78196-50-6 |
|---|---|
| SMILES | CCCCCCCCCCCCOC(=O)CCCCC(=O)O |
Product Overview
Dodecyl hydrogen adipate (CAS 78196-50-6), with molecular formula C18H34O4 and molecular weight 314.25 g/mol. IUPAC: 6-dodecoxy-6-oxohexanoic acid.
Chemical Property Profile of Dodecyl hydrogen adipate
Property Insights of Dodecyl hydrogen adipate
The XLogP value of 5.0955 indicates that Dodecyl hydrogen adipate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Dodecyl hydrogen adipate. Following Lipinski's Rule of Five, Dodecyl hydrogen adipate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dodecyl hydrogen adipate?
The CAS number of Dodecyl hydrogen adipate is 78196-50-6.
What is the molecular formula of Dodecyl hydrogen adipate?
The molecular formula of Dodecyl hydrogen adipate is C18H34O4.
What is the molecular weight of Dodecyl hydrogen adipate?
The molecular weight of Dodecyl hydrogen adipate is 314.25 g/mol.
Where can I buy Dodecyl hydrogen adipate?
You can request a quote for Dodecyl hydrogen adipate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dodecyl hydrogen adipate?
Yes, KEHONG BIO provides custom synthesis services for Dodecyl hydrogen adipate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.