Titanocene dichloride CAS#1271-19-8

Boiling point 

355.52°C (estimate)

density 

1.6 g/mL at 25 °C(lit.)

vapor pressure 

0.002Pa at 25℃

storage temp. 

Inert atmosphere,Room Temperature

solubility 

slightly soluble in H2O, benzene; soluble in chloroform,ethanol, toluene

form 

crystal

Specific Gravity

1.6

color 

red

Water Solubility 

slow decomposition

Sensitive 

Air & Moisture Sensitive

Hydrolytic Sensitivity

4: no reaction with water under neutral conditions

Merck 

14,9482

Stability:

Stable. Incompatible with strong oxidizing agents. Decomposes in water. Moisture sensitive.

InChI

1S/2C5H5.2ClH.Ti/c2*1-2-4-5-3-1;;;/h2*1-5H;2*1H;/q;;;;+2/p-2

InChIKey

XKLWATAZDMHTSH-UHFFFAOYSA-L

SMILES

Cl[Ti]Cl.[CH]1[CH][CH][CH][CH]1.[CH]2[CH][CH][CH][CH]2

LogP

-1.35 at 20℃

CAS DataBase Reference

1271-19-8(CAS DataBase Reference)

NIST Chemistry Reference

Titanocene dichloride(1271-19-8)

EPA Substance Registry System

Titanocene dichloride (1271-19-8)

Safety Information

Risk Statements 

37/38-61-40-34-33-36/37/38

Safety Statements 

36-7/8-6A-45-36/37/39-26

RIDADR 

UN3261

WGK Germany 

3

RTECS 

XR2050000

F 

8-10-21

TSCA 

TSCA listed

HazardClass 

8

PackingGroup 

II

HS Code 

29310095

Storage Class

11 - Combustible Solids

Hazard Classifications

Aquatic Acute 1
Aquatic Chronic 1
Eye Dam. 1
STOT SE 3

Hazardous Substances Data

1271-19-8(Hazardous Substances Data)

Toxicity

Titanocene dichloride may cause skin and mucous membrane irritation. The LD50 in mice has been reported as 60 mg/kg (i.p.) and 180 mg/kg (i.v.). In the rat, the LD50 is 25 mg/kg (i.p.).