ChemSpider 2D Image | (1S)-2,2-Dichloro-1-(4-ethoxyphenyl)cyclopropanecarboxylic acid | C12H12Cl2O3

(1S)-2,2-Dichloro-1-(4-ethoxyphenyl)cyclopropanecarboxylic acid

  • Molecular FormulaC12H12Cl2O3
  • Average mass275.128 Da
  • Monoisotopic mass274.016357 Da
  • ChemSpider ID18550618

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1S)-2,2-Dichlor-1-(4-ethoxyphenyl)cyclopropancarbonsäure [German] [ACD/IUPAC Name]
(1S)-2,2-Dichloro-1-(4-ethoxyphenyl)cyclopropanecarboxylic acid [ACD/IUPAC Name]
Acide (1S)-2,2-dichloro-1-(4-éthoxyphényl)cyclopropanecarboxylique [French] [ACD/IUPAC Name]
Cyclopropanecarboxylic acid, 2,2-dichloro-1-(4-ethoxyphenyl)-, (1S)- [ACD/Index Name]
(1S)-2,2-Dichloro-1-(4-ethoxyphenyl)cyclopropane-1-carboxylic acid
(S)-2,2-Dichloro-1-(4-ethoxyphenyl)cyclopropanecarboxylic acid
63935-60-4 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 391.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 67.6±3.0 kJ/mol
Flash Point: 190.7±27.9 °C
Index of Refraction: 1.590
Molar Refractivity: 65.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.43
ACD/LogD (pH 5.5): 0.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.51
ACD/LogD (pH 7.4): -0.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 47 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 53.8±5.0 dyne/cm
Molar Volume: 194.1±5.0 cm3

Click to predict properties on the Chemicalize site


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