Dichlorobis(methyl-pi-cyclopentadienyl)titanium 双(甲基环戊二烯)二氯化钛

CAS 1282-40-2 MFCD01310453

化学结构图

1282-40-2
SMILES: C[C]1[CH][CH][CH][CH]1.C[C]1[CH][CH][CH][CH]1.Cl[Ti]Cl

化学属性

Mol. FormulaC12H14Cl2Ti
Mol. Weight277.01
Melting Point220-225 °C

别名和识别编码

Chemical NameDichlorobis(methyl-pi-cyclopentadienyl)titanium
Synonym Bis(methylcyclopentadienyl)titanium dichloride {LY} Bis(methylcyclopentadienyl)titanium dichloride {} {LY} Bis(methylcyclopentadienyl)titanium dichloride {} {} {LY} Bis(methylcyclopentadienyl)titanium dichloride {} {} {} {LY} Bis(methylcyclopentadienyl)titanium dichloride {} {} {} {} {LY} Bis(methylcyclopentadienyl)titanium dichloride {} {} {} {} {} {LY} Bis(methylcyclopentadienyl)titanium dichloride {} {} {} {} {} {} {LY} Bis(methylcyclopentadienyl)titanium dichloride {} {} {} {} {} {} {} {LY} Bis(methylcyclopentadienyl)titanium dichloride {} {} {} {} {} {} {} {} {LY} Bis(methylcyclopentadienyl)titanium dichloride {} {} {} {} {} {} {} {} {} {LY} Bis(methylcyclopentadienyl)titanium dichloride {} {} {} {} {} {} {} {} {} {} {LY} Bis(methylcyclopentadienyl)titanium dichloride {} {} {} {} {} {} {} {} {} {} {} {LY} Bis(methylcyclopentadienyl)titanium dichloride {} {} {} {} {} {} {} {} {} {} {} {} {LY} Bis(methylcyclopentadienyl)titanium dichloride {} {} {} {} {} {} {} {
Wiswesser Line NotationL50J A1 0-TI-GG- 0L50J A1
CAS Number1282-40-2
InChIKeyNSBZPLSMZORBHY-UHFFFAOYSA-L
PubChem Substance ID200234
InChIInChI=1S/2C6H7.2ClH.Ti/c2*1-6-4-2-3-5-6;;;/h2*2-5H,1H3;2*1H;/q2*-1;;;+4/p-2
Chemical Name Translation双(甲基环戊二烯)二氯化钛
Canonical SMILES[Cl-][Ti+4]12345678([Cl-])([CH]=9[CH]4=[CH]3[C-]2(C)[CH]91)[CH]=%10[CH]8=[CH]7[C-]6(C)[CH]%105
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分类

  • {uni_hamburg} no charge; metal-organic; other heterocycle; carbocycle; alicycle; fused rings; 3ring; 4ring; 5ring; 6ring; 1fragment; zwitterion

相关文献及参考

  • Short: III/35C4 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Hydrogen-1, Part 4: Inorganic and Organometallic Compounds Author: Gupta, R.R.; Platzer, N. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35C4 Year: 2001 Keyword: Hydrogen 1; Nuclear Magnetic Resonance ISBN: 3-540-41059-7 ISBN: 978-3-540-41059-1 Internet Resource: DOI:10.1007/b76570 RefComment: VII, 299 pages. With CD-ROM. Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), and carbon-13 (subvol. D) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.
  • Short: III/35D5 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Carbon-13, Part 5: Organometallic Compounds Author: Mikhova, Bozhana Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35D5 Year: 2008 Keyword: Carbon-13; chemical shift; magnetic properties of nuclei; nuclear magnetic resonance data ISBN: 978-3-540-74188-6 (print) ISBN: 978-3-540-74189-3 (electronic) Internet Resource: DOI:10.1007/978-3-540-74189-3 RefComment: VIII, 241 p., Hardcover RefComment: Written for Scientists and engineers in the fields of physics, chemistry and physical chemistry who intend to use NMR to study the structure and the binding of molecules Abstract: Nuclear Magnetic Resonance (NMR) is based on the fact that certain nuclei exhibit a magnetic moment, oriented by a magnetic field, and absorb characteristic frequencies in the radiofrequency part of the spectrum.

安全信息

RTECSXR1951000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Unreported
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 30 mg/kg
TOXIC EFFECTS :
   Tumorigenic - active as anti-cancer agent
REFERENCE :
   EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique.
   (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France)
   V.9-    1974-  Volume(issue)/page/year: 16,275,1981

Storage condition

系列性分类

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