ChemSpider 2D Image | (6-Methoxy-2-oxo-2H-chromen-4-yl)methyl 1-pyrrolidinecarbodithioate | C16H17NO3S2

(6-Methoxy-2-oxo-2H-chromen-4-yl)methyl 1-pyrrolidinecarbodithioate

  • Molecular FormulaC16H17NO3S2
  • Average mass335.441 Da
  • Monoisotopic mass335.064972 Da
  • ChemSpider ID30657690

More details:

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

(6-Methoxy-2-oxo-2H-chromen-4-yl)methyl 1-pyrrolidinecarbodithioate [ACD/IUPAC Name]
(6-Methoxy-2-oxo-2H-chromen-4-yl)methyl-1-pyrrolidincarbodithioat [German] [ACD/IUPAC Name]
1-Pyrrolidinecarbodithioate de (6-méthoxy-2-oxo-2H-chromén-4-yl)méthyle [French] [ACD/IUPAC Name]
1-Pyrrolidinecarbodithioic acid, (6-methoxy-2-oxo-2H-1-benzopyran-4-yl)methyl ester [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 513.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.5±3.0 kJ/mol
Flash Point: 264.5±32.9 °C
Index of Refraction: 1.654
Molar Refractivity: 90.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.06
ACD/LogD (pH 5.5): 2.94
ACD/BCF (pH 5.5): 101.91
ACD/KOC (pH 5.5): 952.98
ACD/LogD (pH 7.4): 2.94
ACD/BCF (pH 7.4): 101.91
ACD/KOC (pH 7.4): 953.00
Polar Surface Area: 96 Å2
Polarizability: 36.0±0.5 10-24cm3
Surface Tension: 62.4±3.0 dyne/cm
Molar Volume: 248.0±3.0 cm3

Click to predict properties on the Chemicalize site


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