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Tris(isopropylcyclopentadienyl)praseodymium

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Name

Tris(isopropylcyclopentadienyl)praseodymium

EINECS N/A
CAS No. 69021-86-9 Density N/A
PSA 0.00000 LogP 7.99170
Solubility N/A Melting Point 50-54 °C(lit.)
Formula C24H33Pr Boiling Point 127.2°C at 760 mmHg
Molecular Weight 462.43 Flash Point 68 °C
Transport Information UN 3181 Appearance N/A
Safety 16-43 Risk Codes 11-14/15
Molecular Structure Molecular Structure of 69021-86-9 (TRIS(I-PROPYLCYCLOPENTADIENYL)PRASEODYMIUM) Hazard Symbols FlammableF
Synonyms

1,3-Cyclopentadiene,1-(1-methylethyl)-, praseodymium complex;Tris(isopropylcyclopentadienyl)praseodymium;

 

Tris(isopropylcyclopentadienyl)praseodymium Specification

This chemical is called Tris(isopropylcyclopentadienyl)praseodymium, and its systematic name is 5-isopropylcyclopenta-1,3-diene; isopropylcyclopentane; praseodymium. With the molecular formula of C24H33Pr, its molecular weight is 462.43. The CAS registry number of this chemical is 69021-86-9.

Other characteristics of the Tris(isopropylcyclopentadienyl)praseodymium can be summarised as followings: (1)ACD/LogP: 3.16; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 0; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Flash Point: 13.9 °C; (7)Enthalpy of Vaporization: 34.99 kJ/mol; (8)Boiling Point: 127.2 °C at 760 mmHg; (9)Vapour Pressure: 13.7 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: [Pr].c1c[c-](cc1)C(C)C.c1[c-](ccc1)C(C)C.[CH-]1[CH-][CH-][CH-][C-]1C(C)C
2.InChI: InChI=1/3C8H11.Pr/c3*1-7(2)8-5-3-4-6-8;/h3*3-7H,1-2H3;/q-5;2*-1;
3.InChIKey: CKAKINLSCJPRHF-UHFFFAOYAC

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