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Dicyclopentadienyltitanium dichloride 97%

CAT: 0286-D18370Size: 5 gDry Ice: NoHazardous: No
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CAT#:0286-D18370Size:5 g
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CAS Number
1271-19-8
Synonyms
Cp2TiCl2; Cp2TiCl2, Di (cyclopentadienyl) titanium (IV) dichloride; Dichlorobis (1,3-cyclopentadiene) titanium; Dichlorodicyclopentadienyltitanium; Dichlorotitanocene; Titanocene dichloride; bis (Cyclopentadienyl) titanium (IV) dichloride
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00003723
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Not D.O.T.-Regulated
Precautions
P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

Titanocene dichloride

Titanocene dichloride appears as red to red-orange crystals. (NTP, 1992)

CAS Number1271-19-8
PubChem CID76030824
IUPAC Namebis(cyclopenta-1,3-diene);titanium(4+);dichloride
Molecular FormulaC10H10Cl2Ti
Molecular Weight248.96
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count13
Formal Charge0
Complexity11
SMILES
[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Cl-].[Cl-].[Ti+4]
InChI
InChI=1S/2C5H5.2ClH.Ti/c2*1-2-4-5-3-1;;;/h2*1-5H;2*1H;/q2*-1;;;+4/p-2
InChIKey
YMNCCEXICREQQV-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of Titanocene dichloride
CAS: 1271-19-8
CID: 76030824
Formula: C10H10Cl2Ti
MW: 248.96
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight248.96
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass247.963896
Monoisotopic Mass247.963896
Topological Polar Surface Area0 Ų
Heavy Atom Count13
Formal Charge0
Complexity11.6
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count5
Compound Is CanonicalizedYes

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