ChemSpider 2D Image | (2Z)-2-Amino-3-{(E)-[(3-methyl-2-thienyl)methylene]amino}-2-butenedinitrile | C10H8N4S

(2Z)-2-Amino-3-{(E)-[(3-methyl-2-thienyl)methylene]amino}-2-butenedinitrile

  • Molecular FormulaC10H8N4S
  • Average mass216.262 Da
  • Monoisotopic mass216.046967 Da
  • ChemSpider ID30651758

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-Amino-3-{(E)-[(3-methyl-2-thienyl)methylen]amino}-2-butendinitril [German] [ACD/IUPAC Name]
(2Z)-2-Amino-3-{(E)-[(3-methyl-2-thienyl)methylene]amino}-2-butenedinitrile [ACD/IUPAC Name]
(2Z)-2-Amino-3-{(E)-[(3-méthyl-2-thiényl)méthylène]amino}-2-butènedinitrile [French] [ACD/IUPAC Name]
2-Butenedinitrile, 2-amino-3-[[(1E)-(3-methyl-2-thienyl)methylene]amino]-, (2Z)- [ACD/Index Name]
(2Z)-2-amino-3-{[(1E)-(3-methylthien-2-yl)methylene]amino}bu t-2-enedinitrile

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

Density: 1.2±0.1 g/cm3
Boiling Point: 420.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.4±3.0 kJ/mol
Flash Point: 207.9±28.7 °C
Index of Refraction: 1.639
Molar Refractivity: 62.5±0.5 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.40
ACD/LogD (pH 5.5): 1.74
ACD/BCF (pH 5.5): 12.33
ACD/KOC (pH 5.5): 209.99
ACD/LogD (pH 7.4): 1.74
ACD/BCF (pH 7.4): 12.35
ACD/KOC (pH 7.4): 210.38
Polar Surface Area: 114 Å2
Polarizability: 24.8±0.5 10-24cm3
Surface Tension: 53.0±7.0 dyne/cm
Molar Volume: 173.8±7.0 cm3

Click to predict properties on the Chemicalize site


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