ChemSpider 2D Image | (4S)-6-Chloro-4-(cyclopropylethynyl)-4-(trifluoromethyl)(2-~14~C)-1,4-dihydro-2H-3,1-benzoxazin-2-one | C1314CH9ClF3NO2

(4S)-6-Chloro-4-(cyclopropylethynyl)-4-(trifluoromethyl)(2-14C)-1,4-dihydro-2H-3,1-benzoxazin-2-one

  • Molecular FormulaC1314CH9ClF3NO2
  • Average mass317.668 Da
  • Monoisotopic mass317.030640 Da
  • ChemSpider ID114394260

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(4S)-6-Chlor-4-(cyclopropylethinyl)-4-(trifluormethyl)(2-14C)-1,4-dihydro-2H-3,1-benzoxazin-2-on [German] [ACD/IUPAC Name]
(4S)-6-Chloro-4-(cyclopropylethynyl)-4-(trifluoromethyl)(2-14C)-1,4-dihydro-2H-3,1-benzoxazin-2-one [ACD/IUPAC Name]
(4S)-6-Chloro-4-(cyclopropyléthynyl)-4-(trifluorométhyl)(2-14C)-1,4-dihydro-2H-3,1-benzoxazin-2-one [French] [ACD/IUPAC Name]
2H-3,1-Benzoxazin-2-one-2-14C, 6-chloro-4-(2-cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-, (4S)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.581
Molar Refractivity: 68.4±0.4 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 27.1±0.5 10-24cm3
Surface Tension: 51.3±5.0 dyne/cm
Molar Volume: 205.3±5.0 cm3

Click to predict properties on the Chemicalize site


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