ChemSpider 2D Image | 7-Methoxy-2-(methylsulfanyl)-1,3-benzothiazole | C9H9NOS2

7-Methoxy-2-(methylsulfanyl)-1,3-benzothiazole

  • Molecular FormulaC9H9NOS2
  • Average mass211.304 Da
  • Monoisotopic mass211.012558 Da
  • ChemSpider ID24182757

More details:

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

7-Methoxy-2-(methylsulfanyl)-1,3-benzothiazol [German] [ACD/IUPAC Name]
7-Methoxy-2-(methylsulfanyl)-1,3-benzothiazole [ACD/IUPAC Name]
7-Méthoxy-2-(méthylsulfanyl)-1,3-benzothiazole [French] [ACD/IUPAC Name]
Benzothiazole, 7-methoxy-2-(methylthio)- [ACD/Index Name]
2942-19-0 [RN]
7-methoxy-2-(methylthio)benzo[d]thiazole
BENZO[D]THIAZOLE,7-METHOXY-2-(METHYLTHIO)-
Benzothiazole, 7-methoxy-2-(methylthio)- (7CI,8CI)
MFCD18826676

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

Density: 1.3±0.1 g/cm3
Boiling Point: 343.3±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.4±3.0 kJ/mol
Flash Point: 161.4±25.7 °C
Index of Refraction: 1.664
Molar Refractivity: 59.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.02
ACD/LogD (pH 5.5): 2.86
ACD/BCF (pH 5.5): 87.12
ACD/KOC (pH 5.5): 851.82
ACD/LogD (pH 7.4): 2.86
ACD/BCF (pH 7.4): 87.13
ACD/KOC (pH 7.4): 851.91
Polar Surface Area: 76 Å2
Polarizability: 23.5±0.5 10-24cm3
Surface Tension: 57.5±5.0 dyne/cm
Molar Volume: 159.8±5.0 cm3

Click to predict properties on the Chemicalize site


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