ChemSpider 2D Image | 2-Amino-4-[2-chloro-4-(trifluoromethyl)-1,3-thiazol-5-yl]-3-butyn-1-ol | C8H6ClF3N2OS

2-Amino-4-[2-chloro-4-(trifluoromethyl)-1,3-thiazol-5-yl]-3-butyn-1-ol

  • Molecular FormulaC8H6ClF3N2OS
  • Average mass270.659 Da
  • Monoisotopic mass269.984131 Da
  • ChemSpider ID96008365

More details:

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

2-Amino-4-[2-chlor-4-(trifluormethyl)-1,3-thiazol-5-yl]-3-butin-1-ol [German] [ACD/IUPAC Name]
2-Amino-4-[2-chloro-4-(trifluoromethyl)-1,3-thiazol-5-yl]-3-butyn-1-ol [ACD/IUPAC Name]
2-Amino-4-[2-chloro-4-(trifluorométhyl)-1,3-thiazol-5-yl]-3-butyn-1-ol [French] [ACD/IUPAC Name]
3-Butyn-1-ol, 2-amino-4-[2-chloro-4-(trifluoromethyl)-5-thiazolyl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 427.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.0±3.0 kJ/mol
Flash Point: 212.6±31.5 °C
Index of Refraction: 1.562
Molar Refractivity: 54.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.74
ACD/LogD (pH 5.5): -1.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.50
ACD/BCF (pH 7.4): 1.10
ACD/KOC (pH 7.4): 27.83
Polar Surface Area: 87 Å2
Polarizability: 21.5±0.5 10-24cm3
Surface Tension: 60.3±5.0 dyne/cm
Molar Volume: 167.0±5.0 cm3

Click to predict properties on the Chemicalize site


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