Found 3 results

Search term: VYYCBGHMCNFOGW (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (S)-[(1S,2S)-2-Chlorocyclohexyl](cyclohexyl)methanol | C13H23ClO

(S)-[(1S,2S)-2-Chlorocyclohexyl](cyclohexyl)methanol

  • Molecular FormulaC13H23ClO
  • Average mass230.774 Da
  • Monoisotopic mass230.143738 Da
  • ChemSpider ID62385712

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(S)-[(1S,2S)-2-Chlorcyclohexyl](cyclohexyl)methanol [German] [ACD/IUPAC Name]
(S)-[(1S,2S)-2-Chlorocyclohexyl](cyclohexyl)methanol [ACD/IUPAC Name]
(S)-[(1S,2S)-2-Chlorocyclohexyl](cyclohexyl)méthanol [French] [ACD/IUPAC Name]
Cyclohexanemethanol, 2-chloro-α-cyclohexyl-, (αS,1S,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: 343.4±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 68.0±6.0 kJ/mol
Flash Point: 161.5±20.4 °C
Index of Refraction: 1.505
Molar Refractivity: 64.4±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.06
ACD/LogD (pH 5.5): 3.79
ACD/BCF (pH 5.5): 444.98
ACD/KOC (pH 5.5): 2737.09
ACD/LogD (pH 7.4): 3.79
ACD/BCF (pH 7.4): 444.98
ACD/KOC (pH 7.4): 2737.09
Polar Surface Area: 20 Å2
Polarizability: 25.5±0.5 10-24cm3
Surface Tension: 38.0±5.0 dyne/cm
Molar Volume: 217.2±5.0 cm3

Click to predict properties on the Chemicalize site


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