Found 23 results

Search term: MF = 'C_{3}H_{3}BrN_{2}S'
ChemSpider 2D Image | 2-(Bromomethyl)-1,3,4-thiadiazole | C3H3BrN2S

2-(Bromomethyl)-1,3,4-thiadiazole

  • Molecular FormulaC3H3BrN2S
  • Average mass179.038 Da
  • Monoisotopic mass177.920029 Da
  • ChemSpider ID21614007

More details:

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

1,3,4-Thiadiazole, 2-(bromomethyl)- [ACD/Index Name]
2-(Brommethyl)-1,3,4-thiadiazol [German] [ACD/IUPAC Name]
2-(Bromomethyl)-1,3,4-thiadiazole [ACD/IUPAC Name]
2-(Bromométhyl)-1,3,4-thiadiazole [French] [ACD/IUPAC Name]
499770-90-0 [RN]
MFCD05664663

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

Density: 1.9±0.1 g/cm3
Boiling Point: 240.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 45.8±3.0 kJ/mol
Flash Point: 98.9±27.9 °C
Index of Refraction: 1.623
Molar Refractivity: 33.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.80
ACD/LogD (pH 5.5): 0.98
ACD/BCF (pH 5.5): 3.28
ACD/KOC (pH 5.5): 81.48
ACD/LogD (pH 7.4): 0.98
ACD/BCF (pH 7.4): 3.28
ACD/KOC (pH 7.4): 81.48
Polar Surface Area: 54 Å2
Polarizability: 13.3±0.5 10-24cm3
Surface Tension: 63.4±3.0 dyne/cm
Molar Volume: 94.9±3.0 cm3

Click to predict properties on the Chemicalize site


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