ChemSpider 2D Image | (1S)-1-Cyclopropyl-2-propyn-1-ol | C6H8O

(1S)-1-Cyclopropyl-2-propyn-1-ol

  • Molecular FormulaC6H8O
  • Average mass96.127 Da
  • Monoisotopic mass96.057518 Da
  • ChemSpider ID32786831

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1S)-1-Cyclopropyl-2-propin-1-ol [German] [ACD/IUPAC Name]
(1S)-1-Cyclopropyl-2-propyn-1-ol [ACD/IUPAC Name]
(1S)-1-Cyclopropyl-2-propyn-1-ol [French] [ACD/IUPAC Name]
Cyclopropanemethanol, α-ethynyl-, (αS)- [ACD/Index Name]
(1S)-1-cyclopropylprop-2-yn-1-ol
1841086-69-8 [RN]
MFCD29954674

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

Density: 1.1±0.1 g/cm3
Boiling Point: 143.1±13.0 °C at 760 mmHg
Vapour Pressure: 2.2±0.6 mmHg at 25°C
Enthalpy of Vaporization: 44.3±6.0 kJ/mol
Flash Point: 50.2±12.1 °C
Index of Refraction: 1.537
Molar Refractivity: 27.1±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.33
ACD/LogD (pH 5.5): 0.47
ACD/BCF (pH 5.5): 1.33
ACD/KOC (pH 5.5): 42.78
ACD/LogD (pH 7.4): 0.47
ACD/BCF (pH 7.4): 1.33
ACD/KOC (pH 7.4): 42.78
Polar Surface Area: 20 Å2
Polarizability: 10.7±0.5 10-24cm3
Surface Tension: 52.4±3.0 dyne/cm
Molar Volume: 86.6±3.0 cm3

Click to predict properties on the Chemicalize site


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