ChemSpider 2D Image | 2-Chloro-1-(1H-tetrazol-5-yl)ethanone | C3H3ClN4O

2-Chloro-1-(1H-tetrazol-5-yl)ethanone

  • Molecular FormulaC3H3ClN4O
  • Average mass146.535 Da
  • Monoisotopic mass145.999542 Da
  • ChemSpider ID65457130

More details:

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

2-Chlor-1-(1H-tetrazol-5-yl)ethanon [German] [ACD/IUPAC Name]
2-Chloro-1-(1H-tetrazol-5-yl)ethanone [ACD/IUPAC Name]
2-Chloro-1-(1H-tétrazol-5-yl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-chloro-1-(1H-tetrazol-5-yl)- [ACD/Index Name]
2229591-39-1 [RN]
2-chloro-1-(1H-1,2,3,4-tetrazol-5-yl)ethan-1-one
MFCD32773303

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

Density: 1.6±0.1 g/cm3
Boiling Point: 331.3±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.4±3.0 kJ/mol
Flash Point: 154.2±28.4 °C
Index of Refraction: 1.575
Molar Refractivity: 29.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.06
ACD/LogD (pH 5.5): -2.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.66
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 72 Å2
Polarizability: 11.8±0.5 10-24cm3
Surface Tension: 83.3±3.0 dyne/cm
Molar Volume: 90.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement