ChemSpider 2D Image | (1R,2R)-1,2,4-Tris[(~2~H_1_)methyl]cyclopentane | C8H13D3

(1R,2R)-1,2,4-Tris[(2H1)methyl]cyclopentane

  • Molecular FormulaC8H13D3
  • Average mass115.231 Da
  • Monoisotopic mass115.144028 Da
  • ChemSpider ID107443653

  • 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)-1,2,4-Tris[(2H1)methyl]cyclopentan [German] [ACD/IUPAC Name]
(1R,2R)-1,2,4-Tris[(2H1)methyl]cyclopentane [ACD/IUPAC Name]
(1R,2R)-1,2,4-Tris[(2H1)méthyl]cyclopentane [French] [ACD/IUPAC Name]
Cyclopentane, 1,2,4-tri(methyl-d)-, (1R,2R)- [ACD/Index Name]

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

Density: 0.8±0.1 g/cm3
Boiling Point: 116.3±7.0 °C at 760 mmHg
Vapour Pressure: 21.8±0.1 mmHg at 25°C
Enthalpy of Vaporization: 34.0±0.8 kJ/mol
Flash Point: 9.2±11.7 °C
Index of Refraction: 1.414
Molar Refractivity: 37.2±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.30
ACD/LogD (pH 5.5): 4.27
ACD/BCF (pH 5.5): 1041.45
ACD/KOC (pH 5.5): 5030.67
ACD/LogD (pH 7.4): 4.27
ACD/BCF (pH 7.4): 1041.45
ACD/KOC (pH 7.4): 5030.67
Polar Surface Area: 0 Å2
Polarizability: 14.7±0.5 10-24cm3
Surface Tension: 21.0±3.0 dyne/cm
Molar Volume: 148.7±3.0 cm3

Click to predict properties on the Chemicalize site


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