Found 3 results

Search term: ZALXTZVAKGFBEX (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (1S,2S)-2-Iodo-N-(1-phenylethyl)cyclopropanecarboxamide | C12H14INO

(1S,2S)-2-Iodo-N-(1-phenylethyl)cyclopropanecarboxamide

  • Molecular FormulaC12H14INO
  • Average mass315.150 Da
  • Monoisotopic mass315.011993 Da
  • ChemSpider ID34977812

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

(1S,2S)-2-Iod-N-(1-phenylethyl)cyclopropancarboxamid [German] [ACD/IUPAC Name]
(1S,2S)-2-Iodo-N-(1-phenylethyl)cyclopropanecarboxamide [ACD/IUPAC Name]
(1S,2S)-2-Iodo-N-(1-phényléthyl)cyclopropanecarboxamide [French] [ACD/IUPAC Name]
Cyclopropanecarboxamide, 2-iodo-N-(1-phenylethyl)-, (1S,2S)- [ACD/Index Name]
(1R,2R)-2-Iodo-N-((R)-1-phenylethyl)cyclopropanecarboxamide

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

Density: 1.6±0.1 g/cm3
Boiling Point: 447.1±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.5±3.0 kJ/mol
Flash Point: 224.2±28.4 °C
Index of Refraction: 1.621
Molar Refractivity: 69.1±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.95
ACD/LogD (pH 5.5): 2.21
ACD/BCF (pH 5.5): 28.38
ACD/KOC (pH 5.5): 381.67
ACD/LogD (pH 7.4): 2.21
ACD/BCF (pH 7.4): 28.38
ACD/KOC (pH 7.4): 381.67
Polar Surface Area: 29 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 48.0±5.0 dyne/cm
Molar Volume: 196.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement