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Tris(cyclopentadienyl)praseodymium

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Name

Tris(cyclopentadienyl)praseodymium

EINECS 234-298-0
CAS No. 11077-59-1 Density N/A
PSA 0.00000 LogP 4.48080
Solubility N/A Melting Point 420 °C (lit.)
Formula C15H15Pr Boiling Point 41.5 °C at 760 mmHg
Molecular Weight 336.1873 Flash Point 220°C/0.01mm subl.
Transport Information UN 3395 Appearance yellow to green crystalline powder
Safety 43-7/8 Risk Codes 11-14/15
Molecular Structure Molecular Structure of 11077-59-1 (Tris(cyclopentadienyl)praseodymium) Hazard Symbols FlammableF
Synonyms

Praseodymiumtricyclopentadienide;Praseodymium, tri-p-cyclopentadienyl-;Tri-p-cyclopentadienyl praseodymium;Tricyclopentadienylpraseodymium;Tris(cyclopentadienyl)praseodymium;

 

Tris(cyclopentadienyl)praseodymium Specification

The Tris(cyclopentadienyl)praseodymium(III), with the CAS registry number of 11077-59-1, is also known as Tris(tetramethylcyclopentadienyl)praseodymium(III). It belongs to the product categories of Catalysis and Inorganic Chemistry; Praseodimium Chemical Synthesis; Praseodymium; Precursors by Metal; Vapor Deposition Precursors. Its EINECS registry number is 234-298-0. This chemical's molecular formula is C15H15Pr and molecular weight is 336.19. What's more, its IUPAC name is Cyclopenta-1, 3-diene; praseodymium(3+). In addition, it must be stored in airtight containers and placed in a dry, cool place at -20 °C.

Physical properties about Tris(cyclopentadienyl)praseodymium(III) are: (1)ACD/LogP: 1.79; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.79; (4)ACD/LogD (pH 7.4): 1.79; (5)ACD/BCF (pH 5.5): 13.44; (6)ACD/BCF (pH 7.4): 13.44; (7)ACD/KOC (pH 5.5): 223.49; (8)ACD/KOC (pH 7.4): 223.49; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Enthalpy of Vaporization: 27.4 kJ/mol; (13)Boiling Point: 41.5 °C at 760 mmHg; (14)Vapour Pressure: 418 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
This chemical reacts violently with water, and liberates extremely flammable gases. In addition, this chemical is highly flammable. What's more, it must be stored in tightly closed and dry containers.

You can still convert the following datas into molecular structure:
(1) SMILES: [Pr+3].[c-]1cccc1.c1[c-]ccc1.c1[c-]ccc1
(2) InChI: InChI=1/3C5H5.Pr/c3*1-2-4-5-3-1;/h3*1-5H;/q3*-1;+3
(3) InChIKey: CTHYOYODNXUAHW-UHFFFAOYAH

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