ChemSpider 2D Image | 2-Chloro-4-methyl-5-nitrobenzenethiol | C7H6ClNO2S

2-Chloro-4-methyl-5-nitrobenzenethiol

  • Molecular FormulaC7H6ClNO2S
  • Average mass203.646 Da
  • Monoisotopic mass202.980774 Da
  • ChemSpider ID57408376

More details:

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

2-Chlor-4-methyl-5-nitrobenzolthiol [German] [ACD/IUPAC Name]
2-Chloro-4-methyl-5-nitrobenzenethiol [ACD/IUPAC Name]
2-Chloro-4-méthyl-5-nitrobenzènethiol [French] [ACD/IUPAC Name]
Benzenethiol, 2-chloro-4-methyl-5-nitro- [ACD/Index Name]
1613616-15-1 [RN]
2-chloro-4-methyl-5-nitrobenzene-1-thiol
2-Chloro-4-methyl-5-nitrothiophenol

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

Density: 1.4±0.1 g/cm3
Boiling Point: 308.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.7±3.0 kJ/mol
Flash Point: 140.1±27.9 °C
Index of Refraction: 1.632
Molar Refractivity: 50.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.72
ACD/LogD (pH 5.5): 2.45
ACD/BCF (pH 5.5): 26.75
ACD/KOC (pH 5.5): 210.41
ACD/LogD (pH 7.4): 0.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.11
Polar Surface Area: 85 Å2
Polarizability: 20.1±0.5 10-24cm3
Surface Tension: 53.7±3.0 dyne/cm
Molar Volume: 142.1±3.0 cm3

Click to predict properties on the Chemicalize site


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