ChemSpider 2D Image | (4-Oxo-3(4H)-quinazolinyl)methyl 1-pyrrolidinecarbodithioate | C14H15N3OS2

(4-Oxo-3(4H)-quinazolinyl)methyl 1-pyrrolidinecarbodithioate

  • Molecular FormulaC14H15N3OS2
  • Average mass305.418 Da
  • Monoisotopic mass305.065643 Da
  • ChemSpider ID21124992

More details:

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

(4-Oxo-3(4H)-chinazolinyl)methyl-1-pyrrolidincarbodithioat [German] [ACD/IUPAC Name]
(4-Oxo-3(4H)-quinazolinyl)methyl 1-pyrrolidinecarbodithioate [ACD/IUPAC Name]
1-Pyrrolidinecarbodithioate de (4-oxo-3(4H)-quinazolinyl)méthyle [French] [ACD/IUPAC Name]
1-Pyrrolidinecarbodithioic acid, (4-oxo-3(4H)-quinazolinyl)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: 475.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.9±3.0 kJ/mol
Flash Point: 241.2±31.5 °C
Index of Refraction: 1.718
Molar Refractivity: 86.4±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.75
ACD/LogD (pH 5.5): 1.91
ACD/BCF (pH 5.5): 16.65
ACD/KOC (pH 5.5): 260.59
ACD/LogD (pH 7.4): 1.91
ACD/BCF (pH 7.4): 16.65
ACD/KOC (pH 7.4): 260.59
Polar Surface Area: 93 Å2
Polarizability: 34.2±0.5 10-24cm3
Surface Tension: 57.0±7.0 dyne/cm
Molar Volume: 219.3±7.0 cm3

Click to predict properties on the Chemicalize site


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