ChemSpider 2D Image | 2-[(1R)-1-Carboxy-2-(1-naphthyl)ethyl]-1,3-dioxo-5-isoindolinecarboxylic acid | C22H15NO6

2-[(1R)-1-Carboxy-2-(1-naphthyl)ethyl]-1,3-dioxo-5-isoindolinecarboxylic acid

  • Molecular FormulaC22H15NO6
  • Average mass389.358 Da
  • Monoisotopic mass389.089935 Da
  • ChemSpider ID23317723

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-[(1R)-1-Carboxy-2-(1-naphthyl)ethyl]-1,3-dioxo-5-isoindolincarbonsäure [German] [ACD/IUPAC Name]
2-[(1R)-1-Carboxy-2-(1-naphthyl)ethyl]-1,3-dioxo-5-isoindolinecarboxylic acid [ACD/IUPAC Name]
2-[(1R)-1-carboxy-2-(naphthalen-1-yl)ethyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
2-[(1R)-1-carboxy-2-naphthalen-1-ylethyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
2H-Isoindole-2-acetic acid, 5-carboxy-1,3-dihydro-α-(1-naphthalenylmethyl)-1,3-dioxo-, (αR)- [ACD/Index Name]
Acide 2-[(1R)-1-carboxy-2-(1-naphtyl)éthyl]-1,3-dioxo-5-isoindolinecarboxylique [French] [ACD/IUPAC Name]
(R)-2-(1-carboxy-2-(naphthalen-1-yl)ethyl)-1,3-dioxoisoindoline-5-carboxylic acid
2-[(1R)-1-carboxy-2-(1-naphthalenyl)ethyl]-1,3-dioxo-5-isoindolecarboxylic acid
2-[(1R)-1-carboxy-2-(1-naphthyl)ethyl]-1,3-diketo-isoindoline-5-carboxylic acid
2-[(1R)-1-carboxy-2-(naphthalen-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylic acid

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

Density: 1.5±0.1 g/cm3
Boiling Point: 690.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.3±3.0 kJ/mol
Flash Point: 371.3±31.5 °C
Index of Refraction: 1.729
Molar Refractivity: 102.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.31
ACD/LogD (pH 5.5): -0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 112 Å2
Polarizability: 40.6±0.5 10-24cm3
Surface Tension: 80.5±3.0 dyne/cm
Molar Volume: 256.7±3.0 cm3

Click to predict properties on the Chemicalize site


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