ChemSpider 2D Image | (3E)-3-(1-Hydroxyethylidene)-2,5,7-trimethyl-2,3-dihydro-4H-pyrido[3,2-e][1,2]thiazin-4-one 1,1-dioxide | C12H14N2O4S

(3E)-3-(1-Hydroxyethylidene)-2,5,7-trimethyl-2,3-dihydro-4H-pyrido[3,2-e][1,2]thiazin-4-one 1,1-dioxide

  • Molecular FormulaC12H14N2O4S
  • Average mass282.316 Da
  • Monoisotopic mass282.067413 Da
  • ChemSpider ID26231291

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E) 1,1-Dioxyde de 3-(1-hydroxyéthylidène)-2,5,7-triméthyl-2,3-dihydro-4H-pyrido[3,2-e][1,2]thiazin-4-one [French] [ACD/IUPAC Name]
(3E)-3-(1-Hydroxyethyliden)-2,5,7-trimethyl-2,3-dihydro-4H-pyrido[3,2-e][1,2]thiazin-4-on-1,1-dioxid [German] [ACD/IUPAC Name]
(3E)-3-(1-Hydroxyethylidene)-2,5,7-trimethyl-2,3-dihydro-4H-pyrido[3,2-e][1,2]thiazin-4-one 1,1-dioxide [ACD/IUPAC Name]
4H-Pyrido[3,2-e]-1,2-thiazin-4-one, 2,3-dihydro-3-(1-hydroxyethylidene)-2,5,7-trimethyl-, 1,1-dioxide, (3E)- [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: 490.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.7±3.0 kJ/mol
Flash Point: 250.3±31.5 °C
Index of Refraction: 1.607
Molar Refractivity: 68.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.98
ACD/LogD (pH 5.5): 0.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.82
ACD/LogD (pH 7.4): -1.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 96 Å2
Polarizability: 27.2±0.5 10-24cm3
Surface Tension: 59.6±3.0 dyne/cm
Molar Volume: 199.0±3.0 cm3

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