ChemSpider 2D Image | 2-Chloro-5-[(3E)-3,5-hexadien-1-yn-1-yl]thiophene | C10H7ClS

2-Chloro-5-[(3E)-3,5-hexadien-1-yn-1-yl]thiophene

  • Molecular FormulaC10H7ClS
  • Average mass194.681 Da
  • Monoisotopic mass193.995697 Da
  • ChemSpider ID90429479

  • Double-bond stereo - Double-bond stereo

More details:

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

2-Chlor-5-[(3E)-3,5-hexadien-1-in-1-yl]thiophen [German] [ACD/IUPAC Name]
2-Chloro-5-[(3E)-3,5-hexadien-1-yn-1-yl]thiophene [ACD/IUPAC Name]
2-Chloro-5-[(3E)-3,5-hexadién-1-yn-1-yl]thiophène [French] [ACD/IUPAC Name]
Thiophene, 2-chloro-5-[(3E)-3,5-hexadien-1-yn-1-yl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 283.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 50.2±3.0 kJ/mol
Flash Point: 165.6±14.0 °C
Index of Refraction: 1.598
Molar Refractivity: 55.2±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.59
ACD/LogD (pH 5.5): 4.08
ACD/BCF (pH 5.5): 736.99
ACD/KOC (pH 5.5): 3927.62
ACD/LogD (pH 7.4): 4.08
ACD/BCF (pH 7.4): 736.99
ACD/KOC (pH 7.4): 3927.62
Polar Surface Area: 28 Å2
Polarizability: 21.9±0.5 10-24cm3
Surface Tension: 45.5±5.0 dyne/cm
Molar Volume: 161.7±5.0 cm3

Click to predict properties on the Chemicalize site


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