bis-(Cyclopentadienyl)dimethyltitanium

Inquiry

Molecular Formula:

C12H16Ti

Molecular Weight:

208.13

CAS Number:

1271-66-5

Catalog Number:

1271-66-5

Product Information

Molecular Formula:

C12H16Ti

Molecular Weight:

208.13

Description

Bis-(Cyclopentadienyl)dimethyltitanium is a highly intricate organometallic compound that stands as a crucial entity extensively employed within the realm of the biomedical industry. Its unprecedented and resilient reactivity lends itself perfectly as a catalytic agent amidst multifarious reactions, including the very foundation of polymerization processes and the intricate field of organic synthesis. Furthermore, this remarkable compound has exhibited an extraordinary potential in the poignant domain of antitumor drug development, specifically in undertakings targeting the belligerent cells contributing to breast cancer.

Synonyms

PETATIS REAGENT; BIS(CYCLOPENTADIENYL)DIMETHYLTITANIUM; BIS-(CYCLOPENTADIENYL)-DIMETHYLTITANIUM(IV); DIMETHYLTITANOCENE; Bis(cyclopentadienyl)dimethyltitanium, 5 wt% in toluene; petatis; Bis(cyclopentadienyl)dimethyltitanium, 5 WT% solution in toluene; Bis(cycl

Canonical SMILES

[CH3-].[CH3-].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Ti+2]

InChI

InChI=1S/2C5H5.2CH3.Ti/c2*1-2-4-5-3-1/h2*1-5H2*1H3/q2*-1+2

InChI Key

OXCNMHOFZZXZHZ-UHFFFAOYSA-N

Boiling Point

40 °C

Flash Point

20 °C

Appearance

Orange to Red clear liquid

Storage

<0°C

Safety Information

Hazards

H225:
Highly flammable liquid and vapour.
H304:
May be fatal if swallowed and enters airways.
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
H332:
Harmful if inhaled.
H335:
May cause respiratory irritation.
H336:
May cause drowsiness or dizziness.
H351:
Suspected of causing cancer.
H361:
Suspected of damaging fertility or the unborn child.
H370:
Causes damage to organs.
H372:
Causes damage to organs through prolonged or repeated exposure.

Precautionary Statement

P201:
Obtain special instructions before use.
P210:
Keep away from heat, sparks, open flames, hot surfaces. No smoking.
P260:
Do not breathe dust, fumes, gas, mist, vapours, spray.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P301+P310:
IF SWALLOWED:
Immediately call a POISON CENTER or doctor/physician.
P308+P311:
If exposed or concerned:
Call a POISON CENTER or doctor/physician.
P331:
Do NOT induce vomiting.
P370+P378:
In case of fire:
Use for extinction:

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

208.0731412 g/mol

Monoisotopic Mass

208.0731412 g/mol

Topological Polar Surface Area

0Å²

Heavy Atom Count

Formal Charge

Complexity

14.4

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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bis-(Cyclopentadienyl)dimethyltitanium

Product Information

Safety Information

Computed Properties

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