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2-Imidazolidinone,1-(4-pyridinyl)-

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Name

2-Imidazolidinone,1-(4-pyridinyl)-

EINECS N/A
CAS No. 52210-90-9 Density 1.257g/cm3
PSA 45.23000 LogP 1.00500
Solubility N/A Melting Point 210-212 °C
Formula C8H9N3O Boiling Point N/A
Molecular Weight 163.179 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes 22
Molecular Structure Molecular Structure of 52210-90-9 (1-PYRIDIN-4-YL-IMIDAZOLIDIN-2-ONE) Hazard Symbols Xn
Synonyms

1-(4-Pyridyl)-2-imidazolidinone;1-(Pyridin-4-yl)imidazolidin-2-one;1-Pyridin-4-yl-imidazolidin-2-one >98%;

Article Data 14

2-Imidazolidinone,1-(4-pyridinyl)- Specification

The CAS register number of 2-Imidazolidinone,1-(4-pyridinyl)- is 52210-90-9. It also can be called as 1-(4-Pyridyl)-2-imidazolidinone and the systematic name about this chemical is 1-pyridin-4-ylimidazolidin-2-one. The molecular formula about this chemical is C8H9N3O and the molecular weight is 163.18.

Physical properties about 2-Imidazolidinone,1-(4-pyridinyl)- are: (1)ACD/LogP: -1.00; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 6.04; (6)#H bond acceptors: 4; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 36.44 Å2; (10)Index of Refraction: 1.584; (11)Molar Refractivity: 43.41 cm3; (12)Molar Volume: 129.7 cm3; (13)Polarizability: 17.21x10-24cm3; (14)Surface Tension: 52.7 dyne/cm; (15)Density: 1.257 g/cm3.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C2NCCN2c1ccncc1
(2)InChI: InChI=1/C8H9N3O/c12-8-10-5-6-11(8)7-1-3-9-4-2-7/h1-4H,5-6H2,(H,10,12)
(3)InChIKey: HKCFTGZESMCKJA-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C8H9N3O/c12-8-10-5-6-11(8)7-1-3-9-4-2-7/h1-4H,5-6H2,(H,10,12)
(5)Std. InChIKey: HKCFTGZESMCKJA-UHFFFAOYSA-N

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