ChemSpider 2D Image | Chloro(1,3-thiazol-2-yl)acetonitrile | C5H3ClN2S

Chloro(1,3-thiazol-2-yl)acetonitrile

  • Molecular FormulaC5H3ClN2S
  • Average mass158.609 Da
  • Monoisotopic mass157.970551 Da
  • ChemSpider ID48227005

More details:

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

2-Thiazoleacetonitrile, α-chloro- [ACD/Index Name]
Chlor(1,3-thiazol-2-yl)acetonitril [German] [ACD/IUPAC Name]
Chloro(1,3-thiazol-2-yl)acetonitrile [ACD/IUPAC Name]
Chloro(1,3-thiazol-2-yl)acétonitrile [French] [ACD/IUPAC Name]
1564616-71-2 [RN]
2-chloro-2-(1,3-thiazol-2-yl)acetonitrile
MFCD26811889

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

Density: 1.4±0.1 g/cm3
Boiling Point: 225.5±30.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.2±3.0 kJ/mol
Flash Point: 90.2±24.6 °C
Index of Refraction: 1.585
Molar Refractivity: 37.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.53
ACD/LogD (pH 5.5): 1.54
ACD/BCF (pH 5.5): 8.67
ACD/KOC (pH 5.5): 163.35
ACD/LogD (pH 7.4): 1.54
ACD/BCF (pH 7.4): 8.67
ACD/KOC (pH 7.4): 163.36
Polar Surface Area: 65 Å2
Polarizability: 14.7±0.5 10-24cm3
Surface Tension: 59.3±3.0 dyne/cm
Molar Volume: 110.5±3.0 cm3

Click to predict properties on the Chemicalize site


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