ChemSpider 2D Image | (2S)-1-[(9H-Fluoren-9-ylmethoxy)carbonyl]-2-piperazinecarboxylic acid | C20H20N2O4

(2S)-1-[(9H-Fluoren-9-ylmethoxy)carbonyl]-2-piperazinecarboxylic acid

  • Molecular FormulaC20H20N2O4
  • Average mass352.384 Da
  • Monoisotopic mass352.142303 Da
  • ChemSpider ID21516432

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1-[(9H-Fluoren-9-ylmethoxy)carbonyl]-2-piperazincarbonsäure [German] [ACD/IUPAC Name]
(2S)-1-[(9H-Fluoren-9-ylmethoxy)carbonyl]-2-piperazinecarboxylic acid [ACD/IUPAC Name]
(S)-1-(((9H-Fluoren-9-yl)methoxy)carbonyl)piperazine-2-carboxylic acid
1,2-Piperazinedicarboxylic acid, 1-(9H-fluoren-9-ylmethyl) ester, (2S)- [ACD/Index Name]
915749-50-7 [RN]
Acide (2S)-1-[(9H-fluorén-9-ylméthoxy)carbonyl]-2-pipérazinecarboxylique [French] [ACD/IUPAC Name]
(2S)-1-[(9H-FLUOREN-9-YLMETHOXY)CARBONYL]PIPERAZINE-2-CARBOXYLIC ACID
(2S)-1-[9H-fluoren-9-ylmethoxy(oxo)methyl]-2-piperazinecarboxylic acid
(2S)-1-{[(9H-Fluoren-9-yl)methoxy]carbonyl}piperazine-2-carboxylic acid
(S)-1-(((9H-Fluoren-9-yl)methoxy)carbonyl)piperazine-2-carboxylicacid
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 580.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.3±3.0 kJ/mol
Flash Point: 304.8±30.1 °C
Index of Refraction: 1.621
Molar Refractivity: 94.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.71
ACD/LogD (pH 5.5): 0.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.83
ACD/LogD (pH 7.4): 0.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.06
Polar Surface Area: 79 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 56.4±3.0 dyne/cm
Molar Volume: 267.8±3.0 cm3

Click to predict properties on the Chemicalize site


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