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Titanium(IV) t-butoxide - 99.95%-Ti, high purity , CAS No.3087-39-6
Basic Description
Synonyms
Titanium(IV) tert-butoxide | 2-methylpropan-2-ol;titanium | Titanium tetra-tert-butoxide | Titanium(IV) tert-butoxide, deposition grade | F88228 | SY066695 | tetra-tert-butoxytitanium | SCHEMBL104001 | Titanium( cento) T-butoxide | Titanium(IV) t-butoxide
Specifications & Purity
≥99.95% metals basis
Storage Temp
Argon charged
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Alcohols and polyols
Intermediate Tree Nodes
Not available
Direct Parent
Tertiary alcohols
Alternative Parents
Organic transition metal salts Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Tertiary alcohol - Organic transition metal salt - Hydrocarbon derivative - Organic salt - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as tertiary alcohols. These are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H ).
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.
Names and Identifiers
Pubchem Sid
504761049
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504761049
IUPAC Name
2-methylpropan-2-ol;titanium
INCHI
InChI=1S/4C4H10O.Ti/c4*1-4(2,3)5;/h4*5H,1-3H3;
InChIKey
IZXRSZNHUSJWIQ-UHFFFAOYSA-N
Smiles
CC(C)(C)O.CC(C)(C)O.CC(C)(C)O.CC(C)(C)O.[Ti]
Isomeric SMILES
CC(C)(C)O.CC(C)(C)O.CC(C)(C)O.CC(C)(C)O.[Ti]
PubChem CID
2733945
Molecular Weight
340.35
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Sensitivity
moisture sensitive
Boil Point(°C)
70°C/0.2mm
Molecular Weight
344.350 g/mol
XLogP3
Hydrogen Bond Donor Count
4
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
0
Exact Mass
344.241 Da
Monoisotopic Mass
344.241 Da
Topological Polar Surface Area
80.900 Ų
Heavy Atom Count
21
Formal Charge
0
Complexity
154.000
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
Citations of This Product
1.
Zheng Cao, Qing-Qiao Fu, Hui Gu, Zhen Tian, Xinba Yaer, Juan-Juan Xing, Lei Miao, Xiao-Huan Wang, Hui-Min Liu, Jun Wang.
(2021)
Thermoelectric enhancement in triple-doped strontium titanate with multi-scale microstructure*. Chinese Physics B,
30
(9):
(97204).
2.
Zhe Wang, Jiangjiang Feng, Xiaoliang Li, Rena Oh, Dongdong Shi, Ouardia Akdim, Ming Xia, Liang Zhao, Xiaoyang Huang, Guojie Zhang.
(2021)
Au-Pd nanoparticles immobilized on TiO2 nanosheet as an active and durable catalyst for solvent-free selective oxidation of benzyl alcohol. JOURNAL OF COLLOID AND INTERFACE SCIENCE,
588
(787).
3.
Chaoqun Zhu, Lukun Feng, Binbin Xu, Qingying Lin, Xiaoli Cheng, Jiangxi Chen, Guomei He.
(2020)
Preparation of ultra-high temperature SiC–TiB2 nanocomposites from a single-source polymer precursor. CERAMICS INTERNATIONAL,
46
(19928).
4.
Chen Li, Liting Wei, Min Chen, Jiayi Zhang, Yang Yang, Boping Liu, Yulong Jin.
(2024)
Solvent-free preparation of well-dispersed and highly active CrOx/VOx/TiO2-SiO2 bimetallic catalyst for bimodal UHMWPE/ HDPE in-reactor blends. APPLIED CATALYSIS A-GENERAL,
678
(119736).
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4 Citations
K2415001
