ChemSpider 2D Image | A-836,339 | C16H26N2O2S

A-836,339

  • Molecular FormulaC16H26N2O2S
  • Average mass310.455 Da
  • Monoisotopic mass310.171509 Da
  • ChemSpider ID26286892

More details:






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

A-836,339 [Wiki]
Cyclopropanecarboxamide, N-[3-(2-methoxyethyl)-4,5-dimethyl-2(3H)-thiazolylidene]-2,2,3,3-tetramethyl- [ACD/Index Name]
N-[3-(2-Methoxyethyl)-4,5-dimethyl-1,3-thiazol-2(3H)-yliden]-2,2,3,3-tetramethylcyclopropancarboxamid [German] [ACD/IUPAC Name]
N-[3-(2-Methoxyethyl)-4,5-dimethyl-1,3-thiazol-2(3H)-ylidene]-2,2,3,3-tetramethylcyclopropanecarboxamide [ACD/IUPAC Name]
N-[3-(2-Méthoxyéthyl)-4,5-diméthyl-1,3-thiazol-2(3H)-ylidène]-2,2,3,3-tétraméthylcyclopropanecarboxamide [French] [ACD/IUPAC Name]
1-(tetrahydropyran-4-ylMethyl)-1H-indol-3-yl]-(2,2,3,5-tetraMethylcyclopropyl)Methanone
959746-77-1 [RN]
N-[(2E)-3-(2-methoxyethyl)-4,5-dimethyl-1,3-tiazol-2(3H)-ylden]-2,2,3,3-tetramethylcyclopropancarboxamide
N-[3-(2-methoxyethyl)-4,5-dimethyl-1,3-thiazol-2-ylidene]-2,2,3,3-tetramethylcyclopropane-1-carboxamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 388.4±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.8±3.0 kJ/mol
Flash Point: 188.7±28.4 °C
Index of Refraction: 1.561
Molar Refractivity: 88.0±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.88
ACD/LogD (pH 5.5): 3.78
ACD/BCF (pH 5.5): 441.29
ACD/KOC (pH 5.5): 2720.80
ACD/LogD (pH 7.4): 3.78
ACD/BCF (pH 7.4): 441.29
ACD/KOC (pH 7.4): 2720.80
Polar Surface Area: 67 Å2
Polarizability: 34.9±0.5 10-24cm3
Surface Tension: 36.6±7.0 dyne/cm
Molar Volume: 271.6±7.0 cm3

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