Found 3 results

Search term: AXBNMPTWUWEFAH (Found by InChIKey (skeleton match))
ChemSpider 2D Image | [(2S)-1-Chloro-3-methyl-2-butanyl]benzene | C11H15Cl

[(2S)-1-Chloro-3-methyl-2-butanyl]benzene

  • Molecular FormulaC11H15Cl
  • Average mass182.690 Da
  • Monoisotopic mass182.086227 Da
  • ChemSpider ID75226940

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[(2S)-1-Chlor-3-methyl-2-butanyl]benzol [German] [ACD/IUPAC Name]
[(2S)-1-Chloro-3-methyl-2-butanyl]benzene [ACD/IUPAC Name]
[(2S)-1-Chloro-3-méthyl-2-butanyl]benzène [French] [ACD/IUPAC Name]
Benzene, [(1S)-1-(chloromethyl)-2-methylpropyl]- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 238.3±9.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 45.6±3.0 kJ/mol
Flash Point: 95.8±11.4 °C
Index of Refraction: 1.503
Molar Refractivity: 54.5±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.10
ACD/LogD (pH 5.5): 4.49
ACD/BCF (pH 5.5): 1516.84
ACD/KOC (pH 5.5): 6584.39
ACD/LogD (pH 7.4): 4.49
ACD/BCF (pH 7.4): 1516.84
ACD/KOC (pH 7.4): 6584.39
Polar Surface Area: 0 Å2
Polarizability: 21.6±0.5 10-24cm3
Surface Tension: 31.8±3.0 dyne/cm
Molar Volume: 184.3±3.0 cm3

Click to predict properties on the Chemicalize site


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