ChemSpider 2D Image | 2-Chloro-5-[(4-chloro-1H-pyrazol-1-yl)methyl]-1,3,4-thiadiazole | C6H4Cl2N4S

2-Chloro-5-[(4-chloro-1H-pyrazol-1-yl)methyl]-1,3,4-thiadiazole

  • Molecular FormulaC6H4Cl2N4S
  • Average mass235.094 Da
  • Monoisotopic mass233.953369 Da
  • ChemSpider ID36015328

More details:

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

1,3,4-Thiadiazole, 2-chloro-5-[(4-chloro-1H-pyrazol-1-yl)methyl]- [ACD/Index Name]
2-Chlor-5-[(4-chlor-1H-pyrazol-1-yl)methyl]-1,3,4-thiadiazol [German] [ACD/IUPAC Name]
2-Chloro-5-[(4-chloro-1H-pyrazol-1-yl)methyl]-1,3,4-thiadiazole [ACD/IUPAC Name]
2-Chloro-5-[(4-chloro-1H-pyrazol-1-yl)méthyl]-1,3,4-thiadiazole [French] [ACD/IUPAC Name]
1503696-19-2 [RN]
MFCD23945776

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

Density: 1.8±0.1 g/cm3
Boiling Point: 400.4±51.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.6±3.0 kJ/mol
Flash Point: 196.0±30.4 °C
Index of Refraction: 1.792
Molar Refractivity: 55.2±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.40
ACD/LogD (pH 5.5): 2.08
ACD/BCF (pH 5.5): 22.52
ACD/KOC (pH 5.5): 323.42
ACD/LogD (pH 7.4): 2.08
ACD/BCF (pH 7.4): 22.52
ACD/KOC (pH 7.4): 323.42
Polar Surface Area: 72 Å2
Polarizability: 21.9±0.5 10-24cm3
Surface Tension: 70.3±7.0 dyne/cm
Molar Volume: 130.2±7.0 cm3

Click to predict properties on the Chemicalize site


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