ChemSpider 2D Image | 4-(3-Nitrophenyl)-1,3-thiazol-2(3H)-one | C9H6N2O3S

4-(3-Nitrophenyl)-1,3-thiazol-2(3H)-one

  • Molecular FormulaC9H6N2O3S
  • Average mass222.221 Da
  • Monoisotopic mass222.009918 Da
  • ChemSpider ID26538455

More details:

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

2(3H)-Thiazolone, 4-(3-nitrophenyl)- [ACD/Index Name]
4-(3-Nitrophenyl)-1,3-thiazol-2(3H)-on [German] [ACD/IUPAC Name]
4-(3-Nitrophenyl)-1,3-thiazol-2(3H)-one [ACD/IUPAC Name]
4-(3-Nitrophényl)-1,3-thiazol-2(3H)-one [French] [ACD/IUPAC Name]
4-(3-nitrophenyl)-3H-1,3-thiazol-2-one
856938-77-7 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.682
Molar Refractivity: 56.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.85
ACD/LogD (pH 5.5): 1.65
ACD/BCF (pH 5.5): 10.57
ACD/KOC (pH 5.5): 188.13
ACD/LogD (pH 7.4): 1.59
ACD/BCF (pH 7.4): 9.22
ACD/KOC (pH 7.4): 164.00
Polar Surface Area: 100 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 65.5±3.0 dyne/cm
Molar Volume: 148.0±3.0 cm3

Click to predict properties on the Chemicalize site


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