ChemSpider 2D Image | Z-L-THREONINOL | C12H17NO4

Z-L-THREONINOL

  • Molecular FormulaC12H17NO4
  • Average mass239.268 Da
  • Monoisotopic mass239.115753 Da
  • ChemSpider ID21169658

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

[(2R,3R)-1,3-Dihydroxy-2-butanyl]carbamate de benzyle [French] [ACD/IUPAC Name]
71811-27-3 [RN]
Benzyl [(2R,3R)-1,3-dihydroxy-2-butanyl]carbamate [ACD/IUPAC Name]
Benzyl [(2R,3R)-1,3-dihydroxybutan-2-yl]carbamate
Benzyl-[(2R,3R)-1,3-dihydroxy-2-butanyl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)propyl]-, phenylmethyl ester [ACD/Index Name]
Z-L-THREONINOL
[71811-27-3] [RN]
1353743-66-4 [RN]
161150-55-6 [RN]
More...

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

97230_FLUKA [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 456.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.5±3.0 kJ/mol
Flash Point: 229.7±28.7 °C
Index of Refraction: 1.552
Molar Refractivity: 62.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.26
ACD/LogD (pH 5.5): 0.97
ACD/BCF (pH 5.5): 3.21
ACD/KOC (pH 5.5): 80.28
ACD/LogD (pH 7.4): 0.97
ACD/BCF (pH 7.4): 3.21
ACD/KOC (pH 7.4): 80.27
Polar Surface Area: 79 Å2
Polarizability: 24.9±0.5 10-24cm3
Surface Tension: 50.7±3.0 dyne/cm
Molar Volume: 196.3±3.0 cm3

Click to predict properties on the Chemicalize site


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