Titanium ethoxide - 33-35% TiO2 , CAS No.3087-36-3

CAS: 3087-36-3 Cat. No.: T107173 Formula: C₈H₂₀O₄Ti Molecular Weight: 228.11 Beilstein Registry Number: 3678992 EC Number: 221-410-8 PubChem CID: 76524

GRADE & PURITY 33-35% TiO2

Synonyms

UNII-98L0R4158B | 398FD8EDAL | ETHYL TITANATE(IV) | Titanium, tetraethoxy- | Tetraethyl orthotitanate | Ethyl titanate | TITANIC ACID ETHYL ESTER | Titanium(IV)ethoxide | TITANIUM ETHOXIDE [INCI] | Ebrotidinum [Latin] | Titanium Ethoxide | titanium tetrak

Storage

Room temperature,Argon charged

Shipped In

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Overview

Titanium ethoxide is used widely as a precursor for the synthesis of Ti4+ ions titania nanoparticles by various techniques such as : in the sol-gel synthesis of free-standing ferroelectric lead zirconate titanate nanoparticles spherical titania cores, produced either by hydrolysis of Ti(IV) ethoxide droplets in contact with water vapor or by preadsorption of the titanium alkoxides into/onto the clay mineral platelets and their subsequent hydrolysis and calcination.

Application
Titanium(IV) ethoxide can be used:
As an activator and dehydrating agent for by condensation of (S)-(+)-p-toluenesulfinamide with aldehydes and ketones to form sulfinimines. 
As a Ti4+ ion source to form complexes of titanium (IV) acrylate with methacrylic acid. 
As a catalyst to synthesize esters of sterically hindered alcohols via transesterification reactions.

Specifications

Synonyms

UNII-98L0R4158B | 398FD8EDAL | ETHYL TITANATE(IV) | Titanium, tetraethoxy- | Tetraethyl orthotitanate | Ethyl titanate | TITANIC ACID ETHYL ESTER | Titanium(IV)ethoxide | TITANIUM ETHOXIDE [INCI] | Ebrotidinum [Latin] | Titanium Ethoxide | titanium tetrak

Specifications & Purity

33-35% TiO2

Storage

Room temperature,Argon charged

Shipped In

FedEx DG Service

Names and Identifiers

Pubchem Sid

504755074

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504755074

Canonical Smiles

CC[O-].CC[O-].CC[O-].CC[O-].[Ti+4]

IUPAC Name

ethanolate;titanium(4+)

InChIKey

JMXKSZRRTHPKDL-UHFFFAOYSA-N

INCHI

1S/4C2H5O.Ti/c4*1-2-3;/h4*2H2,1H3;/q4*-1;+4

Isomeric SMILES

CC[O-].CC[O-].CC[O-].CC[O-].[Ti+4]

WGK Germany

3

PubChem CID

76524

UN Number

1993

Packing Group

III

Molecular Weight

228.11

Beilstein

3678992

Reaxy-Rn

3678992

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic salts
    • Class Organic metal salts
      • Subclass Organic transition metal salts

• 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

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Solubility: Soluble in organic solvents. Decomposes in water.
• Sensitivity: Moisture sensitive
• Refractive Index: 1.5033-1.5053
• Flash Point(°F): 28℃
• Flash Point(°C): 28℃
• Boil Point(°C): 150-152°C
• Molecular Weight: 228.110 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 228.084 Da
• Monoisotopic Mass: 228.084 Da
• Topological Polar Surface Area: 92.200 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 2.800
• 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

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