Neodecanoic acid, titanium salt (1:?)
TL;DR: Neodecanoic acid, titanium salt (1:?) (CAS 511-18-2) is a chemical compound with molecular formula C40H76O8Ti and molecular weight 732.50 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetrakis(7,7-dimethyloctanoate);titanium(4+)
Also Known As: Titanium neodecanoate, Neodecanoic acid, titanium salt, Neodecanoic acid,titanium salt, Neodecanoic acid, titanium salt (1:?), 7,7-dimethyloctanoate,titanium(4+)
| Molecular Formula | C40H76O8Ti |
|---|---|
| Molecular Weight | 732.50 g/mol |
| LogP | 6.9291 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 20 |
| Exact Mass | 732.50195 |
| Heavy Atoms | 49 |
| Complexity | 128.0 |
Chemical Identifiers
| CAS Number | 511-18-2 |
|---|---|
| SMILES | CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].[Ti+4] |
| InChIKey | DQKVMDNCLZIACU-UHFFFAOYSA-J |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Neodecanoic acid, titanium salt (1:?) (CAS 511-18-2), with molecular formula C40H76O8Ti and molecular weight 732.50 g/mol. IUPAC: tetrakis(7,7-dimethyloctanoate);titanium(4+).
Chemical Property Profile of Neodecanoic acid, titanium salt (1:?)
Property Insights of Neodecanoic acid, titanium salt (1:?)
The XLogP value of 6.9291 indicates that Neodecanoic acid, titanium salt (1:?) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 161.0 Ų indicates high polarity, suggesting Neodecanoic acid, titanium salt (1:?) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Neodecanoic acid, titanium salt (1:?) has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Neodecanoic acid, titanium salt (1:?)?
The CAS number of Neodecanoic acid, titanium salt (1:?) is 511-18-2.
What is the molecular formula of Neodecanoic acid, titanium salt (1:?)?
The molecular formula of Neodecanoic acid, titanium salt (1:?) is C40H76O8Ti.
What is the molecular weight of Neodecanoic acid, titanium salt (1:?)?
The molecular weight of Neodecanoic acid, titanium salt (1:?) is 732.50 g/mol.
Where can I buy Neodecanoic acid, titanium salt (1:?)?
You can request a quote for Neodecanoic acid, titanium salt (1:?) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Neodecanoic acid, titanium salt (1:?)?
Yes, KEHONG BIO provides custom synthesis services for Neodecanoic acid, titanium salt (1:?) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.