Found 6 results

Search term: MF = 'C_{32}H_{59}N_{3}O_{8}'
ChemSpider 2D Image | N-(3,5-Dihydroxy-2,4-dimethyloctadecanoyl)-L-valyl-N-(1-carboxyvinyl)-L-threoninamide | C32H59N3O8

N-(3,5-Dihydroxy-2,4-dimethyloctadecanoyl)-L-valyl-N-(1-carboxyvinyl)-L-threoninamide

  • Molecular FormulaC32H59N3O8
  • Average mass613.826 Da
  • Monoisotopic mass613.430237 Da
  • ChemSpider ID8945394

  • defined stereocentres - 3 of 7 defined stereocentres

More details:

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

L-Threoninamide, N-(3,5-dihydroxy-2,4-dimethyl-1-oxooctadecyl)-L-valyl-N-(1-carboxyethenyl)- [ACD/Index Name]
N-(3,5-Dihydroxy-2,4-dimethyloctadecanoyl)-L-valyl-N-(1-carboxyvinyl)-L-threoninamid [German] [ACD/IUPAC Name]
N-(3,5-Dihydroxy-2,4-dimethyloctadecanoyl)-L-valyl-N-(1-carboxyvinyl)-L-threoninamide [ACD/IUPAC Name]
N-(3,5-Dihydroxy-2,4-diméthyloctadecanoyl)-L-valyl-N-(1-carboxyvinyl)-L-thréoninamide [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 891.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 147.1±6.0 kJ/mol
Flash Point: 492.7±34.3 °C
Index of Refraction: 1.507
Molar Refractivity: 166.6±0.3 cm3
#H bond acceptors: 11
#H bond donors: 7
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 4
ACD/LogP: 6.66
ACD/LogD (pH 5.5): 3.37
ACD/BCF (pH 5.5): 70.93
ACD/KOC (pH 5.5): 198.28
ACD/LogD (pH 7.4): 1.85
ACD/BCF (pH 7.4): 2.15
ACD/KOC (pH 7.4): 6.02
Polar Surface Area: 185 Å2
Polarizability: 66.0±0.5 10-24cm3
Surface Tension: 43.9±3.0 dyne/cm
Molar Volume: 559.6±3.0 cm3

Click to predict properties on the Chemicalize site


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