ChemSpider 2D Image | 1-Methyldiamantane | C15H22

1-Methyldiamantane

  • Molecular FormulaC15H22
  • Average mass202.335 Da
  • Monoisotopic mass202.172150 Da
  • ChemSpider ID29367645

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(2R,7S,11R,12S)-1-Methylpentacyclo[7.3.1.14,12.02,7.06,11]tetradecan [German] [ACD/IUPAC Name]
(2R,7S,11R,12S)-1-Methylpentacyclo[7.3.1.14,12.02,7.06,11]tetradecane [ACD/IUPAC Name]
(2R,7S,11R,12S)-1-Méthylpentacyclo[7.3.1.14,12.02,7.06,11]tétradécane [French] [ACD/IUPAC Name]
1-Methyldiamantane
26460-76-4 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 272.4±7.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 49.0±0.8 kJ/mol
Flash Point: 102.7±11.7 °C
Index of Refraction: 1.570
Molar Refractivity: 61.4±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 5.54
ACD/LogD (pH 5.5): 4.98
ACD/BCF (pH 5.5): 3567.82
ACD/KOC (pH 5.5): 12145.18
ACD/LogD (pH 7.4): 4.98
ACD/BCF (pH 7.4): 3567.82
ACD/KOC (pH 7.4): 12145.18
Polar Surface Area: 0 Å2
Polarizability: 24.3±0.5 10-24cm3
Surface Tension: 42.5±3.0 dyne/cm
Molar Volume: 187.2±3.0 cm3

Click to predict properties on the Chemicalize site


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