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Search term: GNTZGEZCMHJEGG-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | [3-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfanyl)-4-hydroxyphenyl](1,3-dihydro-2H-isoindol-2-yl)methanone | C23H19NO4S

[3-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfanyl)-4-hydroxyphenyl](1,3-dihydro-2H-isoindol-2-yl)methanone

  • Molecular FormulaC23H19NO4S
  • Average mass405.466 Da
  • Monoisotopic mass405.103485 Da
  • ChemSpider ID129273537

More details:

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

[3-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfanyl)-4-hydroxyphenyl](1,3-dihydro-2H-isoindol-2-yl)methanon [German] [ACD/IUPAC Name]
[3-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfanyl)-4-hydroxyphenyl](1,3-dihydro-2H-isoindol-2-yl)methanone [ACD/IUPAC Name]
[3-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfanyl)-4-hydroxyphényl](1,3-dihydro-2H-isoindol-2-yl)méthanone [French] [ACD/IUPAC Name]
Methanone, [3-[(2,3-dihydro-1,4-benzodioxin-6-yl)thio]-4-hydroxyphenyl](1,3-dihydro-2H-isoindol-2-yl)- [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: 650.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.3±3.0 kJ/mol
Flash Point: 347.0±31.5 °C
Index of Refraction: 1.740
Molar Refractivity: 112.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.34
ACD/LogD (pH 5.5): 3.59
ACD/BCF (pH 5.5): 312.32
ACD/KOC (pH 5.5): 2113.26
ACD/LogD (pH 7.4): 3.20
ACD/BCF (pH 7.4): 128.05
ACD/KOC (pH 7.4): 866.44
Polar Surface Area: 84 Å2
Polarizability: 44.5±0.5 10-24cm3
Surface Tension: 77.3±5.0 dyne/cm
Molar Volume: 278.3±5.0 cm3

Click to predict properties on the Chemicalize site


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