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Search term: QTGVIKLURZZGDG-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-Cyclopentyl-N-(3-fluoro-2-sulfanylbenzoyl)glycine | C14H16FNO3S

N-Cyclopentyl-N-(3-fluoro-2-sulfanylbenzoyl)glycine

  • Molecular FormulaC14H16FNO3S
  • Average mass297.345 Da
  • Monoisotopic mass297.083496 Da
  • ChemSpider ID23197139

More details:

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

Glycine, N-cyclopentyl-N-(3-fluoro-2-mercaptobenzoyl)- [ACD/Index Name]
N-Cyclopentyl-N-(3-fluor-2-sulfanylbenzoyl)glycin [German] [ACD/IUPAC Name]
N-Cyclopentyl-N-(3-fluoro-2-sulfanylbenzoyl)glycine [ACD/IUPAC Name]
N-Cyclopentyl-N-(3-fluoro-2-sulfanylbenzoyl)glycine [French] [ACD/IUPAC Name]
[Cyclopentyl-(3-fluoro-2-mercapto-benzoyl)-amino]-acetic acid

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

Density: 1.4±0.1 g/cm3
Boiling Point: 516.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.0±3.0 kJ/mol
Flash Point: 265.9±30.1 °C
Index of Refraction: 1.602
Molar Refractivity: 75.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.48
ACD/LogD (pH 5.5): -0.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.48
ACD/LogD (pH 7.4): -2.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 96 Å2
Polarizability: 29.9±0.5 10-24cm3
Surface Tension: 57.4±5.0 dyne/cm
Molar Volume: 219.8±5.0 cm3

Click to predict properties on the Chemicalize site


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