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HomeProduct name list1,2,3,4,5-Pentamethylcyclopentadiene

1,2,3,4,5-Pentamethylcyclopentadiene

Synonym(s):1,2,3,4,5-Pentamethylcyclopentadiene

  • CAS NO.:4045-44-7
  • Empirical Formula: C10H16
  • Molecular Weight: 136.23
  • MDL number: MFCD00001354
  • EINECS: 223-743-4
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2024-05-14 11:56:19
1,2,3,4,5-Pentamethylcyclopentadiene Structural

What is 1,2,3,4,5-Pentamethylcyclopentadiene?

Chemical properties

clear colorless to yellowish liquid

The Uses of 1,2,3,4,5-Pentamethylcyclopentadiene

1,2,3,4,5-Pentamethylcyclopentadiene serves as a precursor to the ligand 1,2,3,4,5-pentamethylcyclopentadienyl. It is used as a growth modifier chemical, during metal organic chemical vapor deposition of iron from iron pentacarbonyl. It is used as a ligand in "one-pot" iridium-catalyzed transformation of alcohols to amides. Further, it acts as an electron mediator in the regeneration process of nicotinamide adenine dinucleotide. In addition to this, it undergoes radical cation catalyzed cycloaddition reaction with allenes to get Diels-Alder product.

General Description

Mechanism of the Diels-Alder reaction of paramagneticendohedral metallofullerene and 1,2,3,4,5-pentamethylcyclopentadiene has been studied. Three-step large-scale preparation of 1,2,3,4,5-pentamethylcyclopentadiene has been reported. Reaction of 1,2,3,4,5-pentamethylcyclopentadiene (HCp*) with actinide ions in gas phase has been investigated by laser ablation mass spectrometry. It undergoes radical cation catalyzed cycloaddition with electron rich allenes to form Diels-Alder product.

Properties of 1,2,3,4,5-Pentamethylcyclopentadiene

Boiling point: 58 °C13 mm Hg(lit.)
Density  0.87 g/mL at 25 °C(lit.)
refractive index  n20/D 1.474(lit.)
Flash point: 112 °F
storage temp.  Store below +30°C.
form  Liquid
color  Clear colorless to yellow-orange, may darken on storage
Specific Gravity 0.87
Water Solubility  Miscible with methanol. dichloromethane and ethyl acetate. Slightly miscible with water.
Sensitive  Light Sensitive
BRN  1849832
Stability: store cold
CAS DataBase Reference 4045-44-7(CAS DataBase Reference)
NIST Chemistry Reference 1,3-Cyclopentadiene, 1,2,3,4,5-pentamethyl-(4045-44-7)

Safety information for 1,2,3,4,5-Pentamethylcyclopentadiene

Signal word Warning
Pictogram(s)
ghs
Flame
Flammables
GHS02
GHS Hazard Statements H226:Flammable liquids
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P233:Keep container tightly closed.
P240:Ground/bond container and receiving equipment.
P241:Use explosion-proof electrical/ventilating/lighting/…/equipment.
P242:Use only non-sparking tools.
P243:Take precautionary measures against static discharge.

Computed Descriptors for 1,2,3,4,5-Pentamethylcyclopentadiene

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