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Piperazine, 1-(4-fluoro-2-nitrophenyl)-

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Name

Piperazine, 1-(4-fluoro-2-nitrophenyl)-

EINECS N/A
CAS No. 243128-46-3 Density 1.295 g/cm3
PSA 61.09000 LogP 2.06050
Solubility N/A Melting Point N/A
Formula C10H12FN3O2 Boiling Point 386.2 °C at 760 mmHg
Molecular Weight 225.2196 Flash Point 187.4 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 243128-46-3 (1-(4-FLUORO-2-NITROPHENYL)PIPERAZINE) Hazard Symbols IrritantXi
Synonyms

(4-Fluoro-2-nitrophenyl)piperazine;

 

Piperazine, 1-(4-fluoro-2-nitrophenyl)- Specification

The Piperazine, 1-(4-fluoro-2-nitrophenyl)-, with the CAS registry number 243128-46-3, is also known as (4-Fluoro-2-nitrophenyl)piperazine. It belongs to the product categories of Amines and Anilines; Heterocycles; API intermediates. This chemical's molecular formula is C10H12FN3O2 and molecular weight is 225.2196. Its systematic name is called 1-(4-fluoro-2-nitrophenyl)piperazine. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes.

Physical properties of Piperazine, 1-(4-fluoro-2-nitrophenyl)-: (1)ACD/LogP: 2.03; (2)ACD/LogD (pH 5.5): -0.53; (3)ACD/LogD (pH 7.4): 1.16; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 2.8; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 41.31; (8)#H bond acceptors: 5; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.561; (12)Molar Refractivity: 56.34 cm3; (13)Molar Volume: 173.7 cm3; (14)Surface Tension: 46.3 dyne/cm; (15)Density: 1.295 g/cm3; (16)Flash Point: 187.4 °C; (17)Enthalpy of Vaporization: 63.51 kJ/mol; (18)Boiling Point: 386.2 °C at 760 mmHg; (19)Vapour Pressure: 3.61E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c1cc(F)ccc1N2CCNCC2
(2)InChI: InChI=1/C10H12FN3O2/c11-8-1-2-9(10(7-8)14(15)16)13-5-3-12-4-6-13/h1-2,7,12H,3-6H2
(3)InChIKey: ZPYLKZRKXDCEQI-UHFFFAOYAQ

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