ChemSpider 2D Image | [2-(Allylamino)-4-amino-1,3-thiazol-5-yl](3-pyridinyl)methanone | C12H12N4OS

[2-(Allylamino)-4-amino-1,3-thiazol-5-yl](3-pyridinyl)methanone

  • Molecular FormulaC12H12N4OS
  • Average mass260.315 Da
  • Monoisotopic mass260.073181 Da
  • ChemSpider ID30811074

More details:

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

[2-(Allylamino)-4-amino-1,3-thiazol-5-yl](3-pyridinyl)methanon [German] [ACD/IUPAC Name]
[2-(Allylamino)-4-amino-1,3-thiazol-5-yl](3-pyridinyl)methanone [ACD/IUPAC Name]
[2-(Allylamino)-4-amino-1,3-thiazol-5-yl](3-pyridinyl)méthanone [French] [ACD/IUPAC Name]
[4-Amino-2-(Prop-2-En-1-Ylamino)-1,3-Thiazol-5-Yl](Pyridin-3-Yl)methanone
Methanone, [4-amino-2-(2-propen-1-ylamino)-5-thiazolyl]-3-pyridinyl- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 497.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 254.7±31.5 °C
Index of Refraction: 1.685
Molar Refractivity: 73.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.38
ACD/LogD (pH 5.5): 1.47
ACD/BCF (pH 5.5): 7.74
ACD/KOC (pH 5.5): 150.53
ACD/LogD (pH 7.4): 1.47
ACD/BCF (pH 7.4): 7.75
ACD/KOC (pH 7.4): 150.74
Polar Surface Area: 109 Å2
Polarizability: 29.1±0.5 10-24cm3
Surface Tension: 66.3±3.0 dyne/cm
Molar Volume: 193.3±3.0 cm3

Click to predict properties on the Chemicalize site


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