ChemSpider 2D Image | (4S)-2-[6-Hydroxy(2-~13~C,~15~N)-1,3-benzothiazol-2-yl](2-~13~C)-4,5-dihydro-1,3-thiazole-4-carboxylic acid | C913C2H8N15NO3S2

(4S)-2-[6-Hydroxy(2-13C,15N)-1,3-benzothiazol-2-yl](2-13C)-4,5-dihydro-1,3-thiazole-4-carboxylic acid

  • Molecular FormulaC913C2H8N15NO3S2
  • Average mass283.302 Da
  • Monoisotopic mass283.001373 Da
  • ChemSpider ID58782558
  • 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)-2-[6-Hydroxy(2-13C,15N)-1,3-benzothiazol-2-yl](2-13C)-4,5-dihydro-1,3-thiazol-4-carbonsäure [German] [ACD/IUPAC Name]
(4S)-2-[6-Hydroxy(2-13C,15N)-1,3-benzothiazol-2-yl](2-13C)-4,5-dihydro-1,3-thiazole-4-carboxylic acid [ACD/IUPAC Name]
4-Thiazole-2-13C-carboxylic acid, 4,5-dihydro-2-(6-hydroxy-2-benzothiazolyl-2-13C-3-15N)-, (4S)- [ACD/Index Name]
Acide (4S)-2-[6-hydroxy(2-13C,15N)-1,3-benzothiazol-2-yl](2-13C)-4,5-dihydro-1,3-thiazole-4-carboxylique [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.865
Molar Refractivity: 69.9±0.5 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
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: 27.7±0.5 10-24cm3
Surface Tension: 85.8±7.0 dyne/cm
Molar Volume: 154.5±7.0 cm3

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