ChemSpider 2D Image | 3-(buta-1,3-diynyl)pyridine | C9H5N

3-(buta-1,3-diynyl)pyridine

  • Molecular FormulaC9H5N
  • Average mass127.143 Da
  • Monoisotopic mass127.042198 Da
  • ChemSpider ID24184131

More details:

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

3-(1,3-Butadiin-1-yl)pyridin [German] [ACD/IUPAC Name]
3-(1,3-Butadiyn-1-yl)pyridine [ACD/IUPAC Name]
3-(1,3-Butadiyn-1-yl)pyridine [French] [ACD/IUPAC Name]
3-(buta-1,3-diynyl)pyridine
Pyridine, 3-(1,3-butadiyn-1-yl)- [ACD/Index Name]
3-(buta-1,3-diyn-1-yl)pyridine
648431-98-5 [RN]
MFCD28162486
PYRIDINE, 3-(1,3-BUTADIYNYL)-
Pyridine, 3-(1,3-butadiynyl)- (9CI)
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 216.5±22.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 43.4±3.0 kJ/mol
Flash Point: 83.2±14.9 °C
Index of Refraction: 1.580
Molar Refractivity: 38.9±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.62
ACD/LogD (pH 5.5): 2.13
ACD/BCF (pH 5.5): 24.25
ACD/KOC (pH 5.5): 340.65
ACD/LogD (pH 7.4): 2.13
ACD/BCF (pH 7.4): 24.35
ACD/KOC (pH 7.4): 341.99
Polar Surface Area: 13 Å2
Polarizability: 15.4±0.5 10-24cm3
Surface Tension: 53.7±5.0 dyne/cm
Molar Volume: 116.8±5.0 cm3

Click to predict properties on the Chemicalize site


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