for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Argon charged,Room temperature Ships 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Canonical Smiles | CC(C)C[O-].CC(C)C[O-].CC(C)C[O-].CC(C)C[O-].[Ti+4] |
|---|---|
| IUPAC Name | 2-methylpropan-1-olate;titanium(4+) |
| InChIKey | QUVMSYUGOKEMPX-UHFFFAOYSA-N |
| INCHI | 1S/4C4H9O.Ti/c4*1-4(2)3-5;/h4*4H,3H2,1-2H3;/q4*-1;+4 |
| Isomeric SMILES | CC(C)C[O-].CC(C)C[O-].CC(C)C[O-].CC(C)C[O-].[Ti+4] |
| PubChem CID | 165601 |
| UN Number | 2924 |
| Packing Group | I |
| Molecular Weight | 340.33 |
| Beilstein | 1(3)1564 |
| Reaxy-Rn | 3681868 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3681868&ln= |
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 |
| Class | 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 |
| Description | 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 |
| Sensitivity | Moisture Sensitive |
|---|---|
| Boil Point(°C) | 141 °C/1 mmHg |
| Melt Point(°C) | 40 °C |
| Molecular Weight | 340.320 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 340.209 Da |
| Monoisotopic Mass | 340.209 Da |
| Topological Polar Surface Area | 92.200 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 17.600 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 5 |
| 1. Mian Wang, Xi Mao, Jingye Liu, Bite Deng, Shuai Deng, Shaohong Jin, Wang Li, Jiang Gong, Renhua Deng, Jintao Zhu. (2022) A Versatile 3D-Confined Self-Assembly Strategy for Anisotropic and Ordered Mesoporous Carbon Microparticles. Advanced Science, 9 (25): (2202394). [PMID:35780503] [10.1002/advs.202202394] |
