ChemSpider 2D Image | 8'-(Ethoxymethyl)-2'-methoxy-4,4-dimethyl-1',5',7',8'-tetrahydro-2H,4'H,6H-spiro[cyclohexane-1,6'-pyrido[2,3-d]pyrimidine]-2,4',6-trione | C18H25N3O5

8'-(Ethoxymethyl)-2'-methoxy-4,4-dimethyl-1',5',7',8'-tetrahydro-2H,4'H,6H-spiro[cyclohexane-1,6'-pyrido[2,3-d]pyrimidine]-2,4',6-trione

  • Molecular FormulaC18H25N3O5
  • Average mass363.408 Da
  • Monoisotopic mass363.179413 Da
  • ChemSpider ID21134204

More details:

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

8'-(Ethoxymethyl)-2'-methoxy-4,4-dimethyl-1',5',7',8'-tetrahydro-2H,4'H,6H-spiro[cyclohexane-1,6'-pyrido[2,3-d]pyrimidine]-2,4',6-trione [ACD/IUPAC Name]
Spiro[cyclohexane-1,6'(5'H)-pyrido[2,3-d]pyrimidine]-2,6-dione, 8'-(ethoxymethyl)-7',8'-dihydro-4'-hydroxy-2'-methoxy-4,4-dimethyl- [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: 592.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.6±3.0 kJ/mol
Flash Point: 312.3±32.9 °C
Index of Refraction: 1.581
Molar Refractivity: 92.2±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.03
ACD/LogD (pH 5.5): 0.86
ACD/BCF (pH 5.5): 2.42
ACD/KOC (pH 5.5): 58.41
ACD/LogD (pH 7.4): 0.84
ACD/BCF (pH 7.4): 2.30
ACD/KOC (pH 7.4): 55.56
Polar Surface Area: 102 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 62.5±5.0 dyne/cm
Molar Volume: 276.8±5.0 cm3

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