ChemSpider 2D Image | (1R,2R)-2-(~2~H_5_)Phenylcyclopropanecarboxylic acid | C10H5D5O2

(1R,2R)-2-(2H5)Phenylcyclopropanecarboxylic acid

  • Molecular FormulaC10H5D5O2
  • Average mass167.216 Da
  • Monoisotopic mass167.099457 Da
  • ChemSpider ID48060643

  • defined stereocentres - 2 of 2 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(1R,2R)-2-(2H5)Phenylcyclopropancarbonsäure [German] [ACD/IUPAC Name]
(1R,2R)-2-(2H5)Phenylcyclopropanecarboxylic acid [ACD/IUPAC Name]
Acide (1R,2R)-2-(2H5)phénylcyclopropanecarboxylique [French] [ACD/IUPAC Name]
Cyclopropanecarboxylic acid, 2-(phenyl-d5)-, (1R,2R)- [ACD/Index Name]
107077-95-2 [RN]
rac trans-2-Phenylcyclopropanecarboxylic-d5 Acid

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

Density: 1.3±0.1 g/cm3
Boiling Point: 317.1±31.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 59.0±3.0 kJ/mol
Flash Point: 144.3±19.5 °C
Index of Refraction: 1.600
Molar Refractivity: 44.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.73
ACD/LogD (pH 5.5): 0.84
ACD/BCF (pH 5.5): 1.48
ACD/KOC (pH 5.5): 24.34
ACD/LogD (pH 7.4): -0.97
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 37 Å2
Polarizability: 17.6±0.5 10-24cm3
Surface Tension: 54.6±3.0 dyne/cm
Molar Volume: 129.7±3.0 cm3

Click to predict properties on the Chemicalize site


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