ChemSpider 2D Image | 1-(5-Iodo-3-thienyl)-3-butyn-1-ol | C8H7IOS

1-(5-Iodo-3-thienyl)-3-butyn-1-ol

  • Molecular FormulaC8H7IOS
  • Average mass278.110 Da
  • Monoisotopic mass277.926208 Da
  • ChemSpider ID41755563

More details:

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

1-(5-Iod-3-thienyl)-3-butin-1-ol [German] [ACD/IUPAC Name]
1-(5-Iodo-3-thienyl)-3-butyn-1-ol [ACD/IUPAC Name]
1-(5-Iodo-3-thiényl)-3-butyn-1-ol [French] [ACD/IUPAC Name]
3-Thiophenemethanol, 5-iodo-α-2-propyn-1-yl- [ACD/Index Name]
1599093-88-5 [RN]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 358.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 63.8±3.0 kJ/mol
Flash Point: 170.9±27.9 °C
Index of Refraction: 1.672
Molar Refractivity: 55.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.72
ACD/LogD (pH 5.5): 2.36
ACD/BCF (pH 5.5): 36.47
ACD/KOC (pH 5.5): 456.71
ACD/LogD (pH 7.4): 2.36
ACD/BCF (pH 7.4): 36.47
ACD/KOC (pH 7.4): 456.71
Polar Surface Area: 48 Å2
Polarizability: 22.1±0.5 10-24cm3
Surface Tension: 61.4±3.0 dyne/cm
Molar Volume: 148.8±3.0 cm3

Click to predict properties on the Chemicalize site


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