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Search term: RJWBXEQMPGFCND (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 1-[5-(Methylsulfonyl)-2-nitrophenyl]piperazine | C11H15N3O4S

1-[5-(Methylsulfonyl)-2-nitrophenyl]piperazine

  • Molecular FormulaC11H15N3O4S
  • Average mass285.319 Da
  • Monoisotopic mass285.078339 Da
  • ChemSpider ID22484444

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1-[5-(Methylsulfonyl)-2-nitrophenyl]piperazin [German] [ACD/IUPAC Name]
1-[5-(Methylsulfonyl)-2-nitrophenyl]piperazine [ACD/IUPAC Name]
1-[5-(Méthylsulfonyl)-2-nitrophényl]pipérazine [French] [ACD/IUPAC Name]
Piperazine, 1-[5-(methylsulfonyl)-2-nitrophenyl]- [ACD/Index Name]
1-(5-(methylsulfonyl)-2-nitrophenyl)piperazine
1-(5-METHANESULFONYL-2-NITROPHENYL)PIPERAZINE
1-(5-methylsulfonyl-2-nitrophenyl)piperazine
1-[5-(Methanesulfonyl)-2-nitrophenyl]piperazine
1095010-42-6 [RN]
626-19-7 [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 550.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.1±3.0 kJ/mol
Flash Point: 286.8±30.1 °C
Index of Refraction: 1.579
Molar Refractivity: 70.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.43
ACD/LogD (pH 5.5): -2.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.09
Polar Surface Area: 104 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 50.7±3.0 dyne/cm
Molar Volume: 211.4±3.0 cm3

Click to predict properties on the Chemicalize site






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