Found 19 results

Search term: MF = 'C_{15}H_{11}BrF_{3}NO_{2}S'
ChemSpider 2D Image | (3Z)-3-[2-(5-Bromotetrahydro-2-thiophenyl)-2-oxoethylidene]-7-(trifluoromethyl)-1,3-dihydro-2H-indol-2-one | C15H11BrF3NO2S

(3Z)-3-[2-(5-Bromotetrahydro-2-thiophenyl)-2-oxoethylidene]-7-(trifluoromethyl)-1,3-dihydro-2H-indol-2-one

  • Molecular FormulaC15H11BrF3NO2S
  • Average mass406.217 Da
  • Monoisotopic mass404.964600 Da
  • ChemSpider ID111088376

  • Double-bond stereo - Double-bond stereo

More details:

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

(3Z)-3-[2-(5-Bromotetrahydro-2-thiophenyl)-2-oxoethylidene]-7-(trifluoromethyl)-1,3-dihydro-2H-indol-2-one [ACD/IUPAC Name]
(3Z)-3-[2-(5-Bromotétrahydro-2-thiophényl)-2-oxoéthylidène]-7-(trifluorométhyl)-1,3-dihydro-2H-indol-2-one [French] [ACD/IUPAC Name]
(3Z)-3-[2-(5-Bromtetrahydro-2-thiophenyl)-2-oxoethyliden]-7-(trifluormethyl)-1,3-dihydro-2H-indol-2-on [German] [ACD/IUPAC Name]
2H-Indol-2-one, 3-[2-(5-bromotetrahydro-2-thienyl)-2-oxoethylidene]-1,3-dihydro-7-(trifluoromethyl)-, (3Z)- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 548.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.8±3.0 kJ/mol
Flash Point: 285.5±30.1 °C
Index of Refraction: 1.651
Molar Refractivity: 85.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.47
ACD/LogD (pH 5.5): 2.95
ACD/BCF (pH 5.5): 102.02
ACD/KOC (pH 5.5): 953.73
ACD/LogD (pH 7.4): 2.94
ACD/BCF (pH 7.4): 101.98
ACD/KOC (pH 7.4): 953.33
Polar Surface Area: 71 Å2
Polarizability: 33.9±0.5 10-24cm3
Surface Tension: 59.2±3.0 dyne/cm
Molar Volume: 234.0±3.0 cm3

Click to predict properties on the Chemicalize site


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