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Bis[2,6-difluoro-3-(1H-pyrrol-1-yl)phenyl]titanocene Structure

Bis[2,6-difluoro-3-(1H-pyrrol-1-yl)phenyl]titanocene

Chemical Properties

Melting point 160-170°C
Density  1.43 at 20℃
vapor pressure  0-0.001Pa at 25-50℃
storage temp.  below 5° C
form  Powder
Hydrolytic Sensitivity 4: no reaction with water under neutral conditions
InChI InChI=1S/2C10H6F2N.2C5.Ti/c2*11-8-3-4-10(9(12)7-8)13-5-1-2-6-13;2*1-2-4-5-3-1;/h2*1-6H;;;/q4*-1;+4
InChIKey HRVFAWAOUBYIBB-UHFFFAOYSA-N
SMILES FC1=C(N2C=CC=C2)C=CC(F)=[C-]1[Ti+4]12345678([C-]9=C(C=CC(N%10C=CC=C%10)=C9F)F)(C9=C1[C-]2C3=C49)C1=C5C6=C7[C-]81
LogP 9.5 at 20℃
Surface tension 72.4mN/m at 10g/L and 20℃
EPA Substance Registry System Titanium, bis(.eta.5-2,4-cyclopentadien-1-yl)bis[2,6-difluoro-3-(1H-pyrrol-1-yl)phenyl]- (125051-32-3)

Safety Information

Hazard Codes  F,Xn,N
Risk Statements  36/37/38-51/53-62-48/22-11
Safety Statements  26-36/37/39-61-36/37-33-22-7
TSCA  Yes
HS Code  2914199090

Usage And Synthesis

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