ChemSpider 2D Image | Dimethyl [(E)-(1-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]carbonodithioimidate | C13H14N2O2S2

Dimethyl [(E)-(1-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]carbonodithioimidate

  • Molecular FormulaC13H14N2O2S2
  • Average mass294.392 Da
  • Monoisotopic mass294.049683 Da
  • ChemSpider ID23188712

  • Double-bond stereo - Double-bond stereo

More details:

Featured data source
Natural Product Updates

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

[(E)-(1-Méthoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidène)méthyl]carbonodithioimidate de diméthyle [French] [ACD/IUPAC Name]
Carbonodithioimidic acid, N-[(E)-(1,2-dihydro-1-methoxy-2-oxo-3H-indol-3-ylidene)methyl]-, dimethyl ester [ACD/Index Name]
Dimethyl [(E)-(1-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]carbonodithioimidate [ACD/IUPAC Name]
Dimethyl-[(E)-(1-methoxy-2-oxo-1,2-dihydro-3H-indol-3-yliden)methyl]carbonodithioimidat [German] [ACD/IUPAC Name]
(3E)-3-({[bis(methylsulfanyl)methylidene]amino}methylidene)-1-methoxy-2,3-dihydro-1H-indol-2-one
(3E)-3-({[bis(methylsulfanyl)methylidene]amino}methylidene)-1-methoxyindol-2-one
3-[1-di(methylsulfanyl)methyleneamino-(E)-methylidene]-1-methoxy-2-indolinone
wasalexin A

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

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

Density: 1.3±0.1 g/cm3
Boiling Point: 415.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.8±3.0 kJ/mol
Flash Point: 205.0±31.5 °C
Index of Refraction: 1.626
Molar Refractivity: 81.7±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.16
ACD/LogD (pH 5.5): 2.64
ACD/BCF (pH 5.5): 59.45
ACD/KOC (pH 5.5): 647.94
ACD/LogD (pH 7.4): 2.64
ACD/BCF (pH 7.4): 59.45
ACD/KOC (pH 7.4): 647.94
Polar Surface Area: 93 Å2
Polarizability: 32.4±0.5 10-24cm3
Surface Tension: 46.4±7.0 dyne/cm
Molar Volume: 230.6±7.0 cm3

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