Found 35 results

Search term: MF = 'C_{4}H_{4}ClNO'
ChemSpider 2D Image | 4-Chloro-2-oxobutanenitrile | C4H4ClNO

4-Chloro-2-oxobutanenitrile

  • Molecular FormulaC4H4ClNO
  • Average mass117.534 Da
  • Monoisotopic mass116.998138 Da
  • ChemSpider ID32995981

More details:

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

4-Chlor-2-oxobutannitril [German] [ACD/IUPAC Name]
4-Chloro-2-oxobutanenitrile [ACD/IUPAC Name]
4-Chloro-2-oxobutanenitrile [French] [ACD/IUPAC Name]
Butanenitrile, 4-chloro-2-oxo- [ACD/Index Name]
66582-18-1 [RN]
MFCD19233520

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

Density: 1.2±0.1 g/cm3
Boiling Point: 190.6±23.0 °C at 760 mmHg
Vapour Pressure: 0.5±0.4 mmHg at 25°C
Enthalpy of Vaporization: 42.7±3.0 kJ/mol
Flash Point: 69.1±22.6 °C
Index of Refraction: 1.439
Molar Refractivity: 25.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.11
ACD/LogD (pH 5.5): 0.75
ACD/BCF (pH 5.5): 2.17
ACD/KOC (pH 5.5): 60.65
ACD/LogD (pH 7.4): 0.75
ACD/BCF (pH 7.4): 2.17
ACD/KOC (pH 7.4): 60.65
Polar Surface Area: 41 Å2
Polarizability: 10.1±0.5 10-24cm3
Surface Tension: 40.4±3.0 dyne/cm
Molar Volume: 96.4±3.0 cm3

Click to predict properties on the Chemicalize site


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