Determine the necessary mass, volume, or concentration for preparing a solution.
≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Argon charged,Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Sonrisas canónicas | CCCCC(CC)C[O-].CCCCC(CC)C[O-].CCCCC(CC)C[O-].CCCCC(CC)C[O-].[Ti+4] |
|---|---|
| IUPAC Name | 2-ethylhexan-1-olate;titanium(4+) |
| InChIKey | KTXWGMUMDPYXNN-UHFFFAOYSA-N |
| INCHI | 1S/4C8H17O.Ti/c4*1-3-5-6-8(4-2)7-9;/h4*8H,3-7H2,1-2H3;/q4*-1;+4 |
| Isómeros SMILES | CCCCC(CC)C[O-].CCCCC(CC)C[O-].CCCCC(CC)C[O-].CCCCC(CC)C[O-].[Ti+4] |
| PubChem CID | 101956 |
| Peso molecular | 564.75 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic salts |
| Clase | Organic metal salts |
| Subclass | Organic transition metal salts |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Organic transition metal salts |
| Alternative Parents | Organic zwitterions Organic oxides Hydrocarbon derivatives Alkoxides |
| Molecular Framework | Not available |
| Substituents | Organic transition metal salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Alkoxide - Organooxygen compound - Aliphatic acyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as organic transition metal salts. These are organic salt compounds containing a transition metal atom in its ionic form. |
| External Descriptors | Not available |
| Sensibilidad | Moisture Sensitive |
|---|---|
| Índice de refracción | n20/D 1.479 |
| Punto de inflamación (°F) | 53°C |
| Punto de inflamación (°C) | 53°C |
| Punto de ebullición (°C) | 248-249 °C/11 mmHg |
| Punto de fusión (°C) | <-25℃ |
| Peso molecular | 564.700 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 20 |
| Exact Mass | 564.46 Da |
| Monoisotopic Mass | 564.46 Da |
| Topological Polar Surface Area | 92.200 Ų |
| Heavy Atom Count | 37 |
| Formal Charge | 0 |
| Complexity | 52.500 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 4 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 5 |
| 1. Hanwen Gu, Guochao Yang, Lingtao Wang, Haoxi Jiang. (2024) Self-aldol condensation of acetaldehyde to crotonaldehyde over Lewis acidic metal-incorporated *BEA zeolites. Molecular Catalysis, [PMID:] [10.1016/j.mcat.2024.114666] |
| 2. Jun Li, Yang Yang, Xinjia Yang, Liying Pan, Qiu Zhang, Xueyue Lyu, Siyu Huang, Xinrui Wang, Guangdong Zhao. (2025) Multiphase synergistic enhancement of single-source precursor SiTiBOC ceramics for highly efficient tunable microwave absorption. JOURNAL OF ALLOYS AND COMPOUNDS, [PMID:] [10.1016/j.jallcom.2025.181601] |