ChemSpider 2D Image | TAGLUTIMIDE | C14H16N2O4

TAGLUTIMIDE

  • Molecular FormulaC14H16N2O4
  • Average mass276.288 Da
  • Monoisotopic mass276.110992 Da
  • ChemSpider ID32701499

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(1R,2R,6S,7S)-4-[(3R)-2,6-Dioxo-3-piperidinyl]-4-azatricyclo[5.2.1.02,6]decan-3,5-dion [German] [ACD/IUPAC Name]
(1R,2R,6S,7S)-4-[(3R)-2,6-Dioxo-3-piperidinyl]-4-azatricyclo[5.2.1.02,6]decane-3,5-dione [ACD/IUPAC Name]
(1R,2R,6S,7S)-4-[(3R)-2,6-Dioxo-3-pipéridinyl]-4-azatricyclo[5.2.1.02,6]décane-3,5-dione [French] [ACD/IUPAC Name]
14166-26-8 [RN]
4,7-Methano-1H-isoindole-1,3(2H)-dione, 2-[(3R)-2,6-dioxo-3-piperidinyl]hexahydro-, (3aR,4R,7S,7aS)- [ACD/Index Name]
TAGLUTIMIDE [INN]
UNII:X94T930W1C
X94T930W1C
UNII-X94T930W1C

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

4486 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 553.3±43.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.4±3.0 kJ/mol
Flash Point: 288.5±28.2 °C
Index of Refraction: 1.603
Molar Refractivity: 66.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.06
ACD/LogD (pH 5.5): 0.81
ACD/BCF (pH 5.5): 2.43
ACD/KOC (pH 5.5): 65.80
ACD/LogD (pH 7.4): 0.81
ACD/BCF (pH 7.4): 2.43
ACD/KOC (pH 7.4): 65.77
Polar Surface Area: 84 Å2
Polarizability: 26.2±0.5 10-24cm3
Surface Tension: 60.8±3.0 dyne/cm
Molar Volume: 192.6±3.0 cm3

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