ChemSpider 2D Image | (2S)-2-(2-Hydroxy-2-propanyl)-10-methylspiro[4.5]dec-6-ene-6-carboxylic acid | C15H24O3

(2S)-2-(2-Hydroxy-2-propanyl)-10-methylspiro[4.5]dec-6-ene-6-carboxylic acid

  • Molecular FormulaC15H24O3
  • Average mass252.349 Da
  • Monoisotopic mass252.172546 Da
  • ChemSpider ID82965444

  • defined stereocentres - 1 of 3 defined stereocentres

More details:

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

(2S)-2-(2-Hydroxy-2-propanyl)-10-methylspiro[4.5]dec-6-en-6-carbonsäure [German] [ACD/IUPAC Name]
(2S)-2-(2-Hydroxy-2-propanyl)-10-methylspiro[4.5]dec-6-ene-6-carboxylic acid [ACD/IUPAC Name]
Acide (2S)-2-(2-hydroxy-2-propanyl)-10-méthylspiro[4.5]déc-6-ène-6-carboxylique [French] [ACD/IUPAC Name]
Spiro[4.5]dec-6-ene-6-carboxylic acid, 2-(1-hydroxy-1-methylethyl)-10-methyl-, (2S)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 403.0±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 75.6±6.0 kJ/mol
Flash Point: 211.7±20.5 °C
Index of Refraction: 1.535
Molar Refractivity: 70.3±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.11
ACD/LogD (pH 5.5): 2.67
ACD/BCF (pH 5.5): 44.59
ACD/KOC (pH 5.5): 347.29
ACD/LogD (pH 7.4): 0.91
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.92
Polar Surface Area: 58 Å2
Polarizability: 27.9±0.5 10-24cm3
Surface Tension: 44.7±5.0 dyne/cm
Molar Volume: 225.7±5.0 cm3

Click to predict properties on the Chemicalize site


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