4419-47-0|TDEAT|Tetrakis(diethylamino)titanium(IV)|Tetrakis(diethylamido)titanium(...

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diethyl[tris(diethylamino)titanio]amine: ChemBase ID: 143386; Molecular Formular: C16H40N4Ti; Molecular Mass: 336.3826; Monoisotopic Mass: 336.2732436
SMILES and InChIs

SMILES:
CCN(CC)[Ti](N(CC)CC)(N(CC)CC)N(CC)CC
Canonical SMILES:
CCN([Ti](N(CC)CC)(N(CC)CC)N(CC)CC)CC
InChI:
InChI=1S/4C4H10N.Ti/c4*1-3-5-4-2;/h4*3-4H2,1-2H3;/q4*-1;+4
InChIKey:
VJDVOZLYDLHLSM-UHFFFAOYSA-N
Cite this record CBID:143386 http://www.chembase.cn/molecule-143386.html

NAMES AND DATABASE IDS

Names Database IDs

IUPAC name

diethyl[tris(diethylamino)titanio]amine

IUPAC Traditional name

diethyl[tris(diethylamino)titanio]amine

Synonyms

TDEAT

Tetrakis(diethylamino)titanium(IV)

Titanium(IV) tetrakis(diethylamide)

Tetrakis(diethylamido)titanium(IV)

四(二乙基氨基)钛(IV)

四(二乙胺基钛)

四(二乙基胺基)钛(IV)

CAS Number

4419-47-0

MDL Number

MFCD00015648

Beilstein Number

3621431

PubChem SID

24865447

24888920

24870619

162237606

PubChem CID

123216

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources

Data Source	Data ID
Sigma Aldrich	469866 407399 725536 87590
PubChem	123216

Data Source

Data ID

Price

Sigma Aldrich

469866	Please log in.
407399	Please log in.
725536	Please log in.
87590	Please log in.

Data Source	Data ID
PubChem	123216

CALCULATED PROPERTIES

JChem

H Acceptors	4	H Donor	0
LogD (pH = 5.5)	-2.8019404	LogD (pH = 7.4)	-1.5011462
Log P	1.8928	Molar Refractivity	93.5624 cm³
Polarizability	39.7664 Å³	Polar Surface Area	12.96 Å²
Rotatable Bonds	12	Lipinski's Rule of Five	true

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)

Apperance

liquid

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Boiling Point

112 °C/0.1 mmHg(lit.)

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Flash Point

-18.4 °F	Show data source Sigma Aldrich - 725536 Sigma Aldrich - 407399 Sigma Aldrich - 469866 Sigma Aldrich - 87590
-28 °C	Show data source Sigma Aldrich - 725536 Sigma Aldrich - 407399 Sigma Aldrich - 469866 Sigma Aldrich - 87590

Density

0.931 g/mL at 25 °C(lit.)

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Refractive Index

n20/D 1.536(lit.)	Show data source Sigma Aldrich - 725536 Sigma Aldrich - 407399 Sigma Aldrich - 469866 Sigma Aldrich - 87590
n20/D 1.538	Show data source Sigma Aldrich - 87590

European Hazard Symbols

Corrosive (C)	Show data source Sigma Aldrich - 725536 Sigma Aldrich - 407399 Sigma Aldrich - 469866 Sigma Aldrich - 87590
Flammable (F)	Show data source Sigma Aldrich - 725536 Sigma Aldrich - 407399 Sigma Aldrich - 469866 Sigma Aldrich - 87590

UN Number

3398	Show data source Sigma Aldrich - 407399 Sigma Aldrich - 469866 Sigma Aldrich - 87590

MSDS Link

Download	Show data source Sigma Aldrich - 407399
Download	Show data source Sigma Aldrich - 469866
Download	Show data source Sigma Aldrich - 725536
Download	Show data source Sigma Aldrich - 87590

German water hazard class

3	Show data source Sigma Aldrich - 725536 Sigma Aldrich - 407399 Sigma Aldrich - 469866 Sigma Aldrich - 87590

Hazard Class

4.3	Show data source Sigma Aldrich - 407399 Sigma Aldrich - 469866 Sigma Aldrich - 87590

Packing Group

1	Show data source Sigma Aldrich - 407399 Sigma Aldrich - 469866 Sigma Aldrich - 87590

Risk Statements

11-14/15-34

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Safety Statements

26-36/37/39-43-45

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GHS Pictograms

	Show data source Sigma Aldrich - 725536 Sigma Aldrich - 407399 Sigma Aldrich - 469866 Sigma Aldrich - 87590
	Show data source Sigma Aldrich - 725536 Sigma Aldrich - 407399 Sigma Aldrich - 469866 Sigma Aldrich - 87590

GHS Signal Word

Danger

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GHS Hazard statements

H225-H260-H314

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GHS Precautionary statements

P210-P223-P231 + P232-P280-P370 + P378-P422

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Personal Protective Equipment

Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

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RID/ADR

UN 3398 4.3/PG 1

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Purity

≥98.0% (NT)	Show data source Sigma Aldrich - 87590
99.999% trace metals basis	Show data source Sigma Aldrich - 469866

Grade

technical	Show data source Sigma Aldrich - 87590
technical grade	Show data source Sigma Aldrich - 407399

Linear Formula

[(C2H5)2N]4Ti

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DETAILS

Sigma Aldrich

Sigma Aldrich - 469866

General description
Please inquire for bulk quantity, pricing, and packaging options.
Packaging
5, 25 g in ampule
Application
Precursor to titanium nitride (TiN) thin films by organometallic chemical vapor deposition (OMCVD).1

Sigma Aldrich - 407399

Packaging
1, 5 g in glass bottle

Sigma Aldrich - 725536

Frequently Asked Questions
Live Chat and Frequently Asked Questions are available for this Product.
General description
Atomic number of base material: 22 Titanium
Packaging
10 g in ss cylinder
Protocols & Applications
Precursors Packaged for Depositions Systems

Sigma Aldrich - 87590

Caution
may contain precipitate
Other Notes
Versatile organo-titanium reagent1,2