ChemSpider 2D Image | (3s,5s,7s)-1-Methyladamantane | C11H18

(3s,5s,7s)-1-Methyladamantane

  • Molecular FormulaC11H18
  • Average mass150.261 Da
  • Monoisotopic mass150.140854 Da
  • ChemSpider ID50165559

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

(3s,5s,7s)-1-Methyladamantan [German] [ACD/IUPAC Name]
(3s,5s,7s)-1-Methyladamantane [ACD/IUPAC Name]
(3s,5s,7s)-1-Méthyladamantane [French] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane, 1-methyl- [ACD/Index Name]
(3R,5S,7s)-1-methyladamantane
1-Methyladamantane [ACD/IUPAC Name]
768-91-2 [RN]
MFCD00216215 [MDL number]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 192.8±7.0 °C at 760 mmHg
Vapour Pressure: 0.7±0.2 mmHg at 25°C
Enthalpy of Vaporization: 41.1±0.8 kJ/mol
Flash Point: 55.4±11.7 °C
Index of Refraction: 1.519
Molar Refractivity: 46.8±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.70
ACD/LogD (pH 5.5): 4.13
ACD/BCF (pH 5.5): 807.81
ACD/KOC (pH 5.5): 4194.23
ACD/LogD (pH 7.4): 4.13
ACD/BCF (pH 7.4): 807.81
ACD/KOC (pH 7.4): 4194.23
Polar Surface Area: 0 Å2
Polarizability: 18.6±0.5 10-24cm3
Surface Tension: 37.0±3.0 dyne/cm
Molar Volume: 154.2±3.0 cm3

Click to predict properties on the Chemicalize site


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