ChemSpider 2D Image | Chloro(methoxy)acetonitrile | C3H4ClNO

Chloro(methoxy)acetonitrile

  • Molecular FormulaC3H4ClNO
  • Average mass105.523 Da
  • Monoisotopic mass104.998138 Da
  • ChemSpider ID60605789

More details:

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

Acetonitrile, 2-chloro-2-methoxy- [ACD/Index Name]
Chlor(methoxy)acetonitril [German] [ACD/IUPAC Name]
Chloro(methoxy)acetonitrile [ACD/IUPAC Name]
Chloro(méthoxy)acétonitrile [French] [ACD/IUPAC Name]
37849-24-4 [RN]
MFCD20630649

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

Density: 1.2±0.1 g/cm3
Boiling Point: 137.1±25.0 °C at 760 mmHg
Vapour Pressure: 7.2±0.3 mmHg at 25°C
Enthalpy of Vaporization: 37.4±3.0 kJ/mol
Flash Point: 36.7±23.2 °C
Index of Refraction: 1.415
Molar Refractivity: 22.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.34
ACD/LogD (pH 5.5): 0.69
ACD/BCF (pH 5.5): 1.99
ACD/KOC (pH 5.5): 56.93
ACD/LogD (pH 7.4): 0.69
ACD/BCF (pH 7.4): 1.99
ACD/KOC (pH 7.4): 56.93
Polar Surface Area: 33 Å2
Polarizability: 8.9±0.5 10-24cm3
Surface Tension: 33.4±3.0 dyne/cm
Molar Volume: 89.6±3.0 cm3

Click to predict properties on the Chemicalize site


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