ChemSpider 2D Image | 2-[(1E)-1-Buten-3-yn-1-yl]pyridine | C9H7N

2-[(1E)-1-Buten-3-yn-1-yl]pyridine

  • Molecular FormulaC9H7N
  • Average mass129.159 Da
  • Monoisotopic mass129.057846 Da
  • ChemSpider ID21417194

  • Double-bond stereo - Double-bond stereo

More details:

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

2-[(1E)-1-Buten-3-in-1-yl]pyridin [German] [ACD/IUPAC Name]
2-[(1E)-1-Buten-3-yn-1-yl]pyridine [ACD/IUPAC Name]
2-[(1E)-1-Butén-3-yn-1-yl]pyridine [French] [ACD/IUPAC Name]
Pyridine, 2-[(1E)-1-buten-3-yn-1-yl]- [ACD/Index Name]
((e)-2-but-1-en-3-ynyl)-pyridine
(E)-2-(but-1-en-3-yn-1-yl)pyridine
134541-96-1 [RN]
2-(BUT-1-EN-3-YN-1-YL)PYRIDINE
2-[(1E)-BUT-1-EN-3-YN-1-YL]PYRIDINE
MFCD28161791
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 211.9±23.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.4 mmHg at 25°C
Enthalpy of Vaporization: 43.0±3.0 kJ/mol
Flash Point: 79.5±15.2 °C
Index of Refraction: 1.605
Molar Refractivity: 42.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.19
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 14.46
ACD/KOC (pH 5.5): 230.09
ACD/LogD (pH 7.4): 1.88
ACD/BCF (pH 7.4): 15.69
ACD/KOC (pH 7.4): 249.63
Polar Surface Area: 13 Å2
Polarizability: 16.9±0.5 10-24cm3
Surface Tension: 46.3±3.0 dyne/cm
Molar Volume: 123.9±3.0 cm3

Click to predict properties on the Chemicalize site


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