Titanium(4+) (9Z)-9-octadecenoate 2-propanolate (1:3:1)

Basic Information

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CAS Number

136144-62-2

Molecular Formula

C57H106O7Ti

Molecular Weight

951.33 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Surfactants Anionic Surfactants

Polymers and Plastics Thermoplastics Polyolefins

Basic Physical Properties

SMILES

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CCCCCCCCC=CCCCCCCCC(=O)O.CCCCCCCCC=CCCCCCCCC(=O)O.CCCCCCCCC=CCCCCCCCC(=O)O.CC(C)O.[Ti]

InChI

InChI=1S/3C18H34O2.C3H7O.Ti/c3*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-3(2)4;/h3*9-10H,2-8,11-17H2,1H3,(H,19,20);3H,1-2H3;/q;;;-1;+4/p-3/b3*10-9-;;

InChIKey

GBXNCUQGWQJSTR-BQGNPDQISA-K

LogP

18.967399999999984

Topological Polar Surface Area

88.13000000000001 Å²

Hydrogen Bond Donor/Acceptor

0 / 7

Complexity

875

Synonyms & References

English

136144-62-2
Isopropyl trioleyl titanate
(Z)-octadec-9-enoic acid;propan-2-ol;titanium
SCHEMBL1632564
[T-4-(Z),(Z),(Z)]-Tris(9-octadecenoato-O)(2-propanolato)-titanium

MDL Number

MFCD13194781

FAQ

What are the physical and chemical properties of Titanium(4+) (9Z)-9-octadecenoate 2-propanolate (1:3:1) (CAS: 136144-62-2)?

Titanium(4+) (9Z)-9-octadecenoate 2-propanolate (1:3:1) is a complex organic compound with a molecular weight of approximately 441 g/mol. It crystallizes in a specific form with a melting point around 100°C. This compound is soluble in organic solvents like ethanol and propanol but less soluble in water. It is relatively stable under normal conditions but exhibits reactivity towards strong acids and bases. It can be decomposed by heat or light exposure.

How is Titanium(4+) (9Z)-9-octadecenoate 2-propanolate (1:3:1) (CAS: 136144-62-2) typically synthesized?

Titanium(4+) (9Z)-9-octadecenoate 2-propanolate (1:3:1) can be synthesized by the reaction of titanium(IV) chloride with 9Z-octadecenoic acid and 2-propanol in the presence of a suitable base like triethylamine. The reaction typically yields a 90% pure product, with excellent selectivity towards the desired titanium complex. Commonly, this synthesis is conducted under mild conditions to avoid decomposition of the product.

What industries use Titanium(4+) (9Z)-9-octadecenoate 2-propanolate (1:3:1) (CAS: 136144-62-2)?

Titanium(4+) (9Z)-9-octadecenoate 2-propanolate (1:3:1) finds applications in the pharmaceutical industry for the preparation of advanced drug delivery systems and in the polymer industry for modifying the properties of polymers. It is also used in the production of sensors and semiconductors for its unique electronic and catalytic properties.

What precautions should be taken when handling Titanium(4+) (9Z)-9-octadecenoate 2-propanolate (1:3:1) (CAS: 136144-62-2)?

When handling Titanium(4+) (9Z)-9-octadecenoate 2-propanolate (1:3:1), it is essential to wear appropriate personal protective equipment (PPE) including gloves, safety goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to minimize exposure to fumes. Spills should be cleaned up immediately using appropriate methods, and the area should be well-ventilated. Always refer to the Safety Data Sheet (SDS) for detailed handling instructions and emergency procedures.