ChemSpider 2D Image | 10-Chloro-2-(~2~H_3_)methyl-11b-phenyl(2,3,3-~2~H_3_)-2,3,7,11b-tetrahydro[1,3]oxazolo[3,2-d][1,4]benzodiazepin-6(5H)-one | C18H11D6ClN2O2

10-Chloro-2-(2H3)methyl-11b-phenyl(2,3,3-2H3)-2,3,7,11b-tetrahydro[1,3]oxazolo[3,2-d][1,4]benzodiazepin-6(5H)-one

  • Molecular FormulaC18H11D6ClN2O2
  • Average mass334.830 Da
  • Monoisotopic mass334.135529 Da
  • ChemSpider ID48060580

  • Non-standard isotope - Non-standard isotope

More details:

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

10-Chlor-2-(2H3)methyl-11b-phenyl(2,3,3-2H3)-2,3,7,11b-tetrahydro[1,3]oxazolo[3,2-d][1,4]benzodiazepin-6(5H)-on [German] [ACD/IUPAC Name]
10-Chloro-2-(2H3)methyl-11b-phenyl(2,3,3-2H3)-2,3,7,11b-tetrahydro[1,3]oxazolo[3,2-d][1,4]benzodiazepin-6(5H)-one [ACD/IUPAC Name]
10-Chloro-2-(2H3)méthyl-11b-phényl(2,3,3-2H3)-2,3,7,11b-tétrahydro[1,3]oxazolo[3,2-d][1,4]benzodiazépin-6(5H)-one [French] [ACD/IUPAC Name]
Oxazolo[3,2-d][1,4]benzodiazepin-6(5H)-one-2,3-d2, 10-chloro-2,3,7,11b-tetrahydro-3-d-2-(methyl-d3)-11b-phenyl- [ACD/Index Name]
10-chloro-2,3,3-trideuterio-11b-phenyl-2-(trideuteriomethyl)-5,7-dihydro-[1,3]oxazolo[3,2-d][1,4]benzodiazepin-6-one
1346602-03-6 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 495.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.3±3.0 kJ/mol
Flash Point: 253.7±28.7 °C
Index of Refraction: 1.668
Molar Refractivity: 89.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.11
ACD/LogD (pH 5.5): 3.13
ACD/BCF (pH 5.5): 140.54
ACD/KOC (pH 5.5): 1199.23
ACD/LogD (pH 7.4): 3.13
ACD/BCF (pH 7.4): 140.66
ACD/KOC (pH 7.4): 1200.27
Polar Surface Area: 42 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 60.5±5.0 dyne/cm
Molar Volume: 239.7±5.0 cm3

Click to predict properties on the Chemicalize site


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