ChemSpider 2D Image | Ethyl (3S,4S)-4-amino-3-hydroxy-6-methylheptanoate | C10H21NO3

Ethyl (3S,4S)-4-amino-3-hydroxy-6-methylheptanoate

  • Molecular FormulaC10H21NO3
  • Average mass203.279 Da
  • Monoisotopic mass203.152145 Da
  • ChemSpider ID18566497

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S,4S)-4-Amino-3-hydroxy-6-méthylheptanoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl (3S,4S)-4-amino-3-hydroxy-6-methylheptanoate [ACD/IUPAC Name]
Ethyl-(3S,4S)-4-amino-3-hydroxy-6-methylheptanoat [German] [ACD/IUPAC Name]
Heptanoic acid, 4-amino-3-hydroxy-6-methyl-, ethyl ester, (3S,4S)- [ACD/Index Name]

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

Density: 1.0±0.0 g/cm3
Boiling Point: 311.3±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 64.0±0.0 kJ/mol
Flash Point: 142.1±0.0 °C
Index of Refraction: 1.464
Molar Refractivity: 55.1±0.0 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.15
ACD/LogD (pH 5.5): -1.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.19
Polar Surface Area: 73 Å2
Polarizability: 21.8±0.0 10-24cm3
Surface Tension: 37.3±0.0 dyne/cm
Molar Volume: 199.4±0.0 cm3

Click to predict properties on the Chemicalize site


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