Found 1 result

Search term: MVMDFINYRHLBPT (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-Isothiocyanato-1,1-dimethylcyclopropane | C6H9NS

2-Isothiocyanato-1,1-dimethylcyclopropane

  • Molecular FormulaC6H9NS
  • Average mass127.207 Da
  • Monoisotopic mass127.045570 Da
  • ChemSpider ID38964606

More details:

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

2-Isothiocyanato-1,1-dimethylcyclopropan [German] [ACD/IUPAC Name]
2-Isothiocyanato-1,1-dimethylcyclopropane [ACD/IUPAC Name]
2-Isothiocyanato-1,1-diméthylcyclopropane [French] [ACD/IUPAC Name]
Cyclopropane, 2-isothiocyanato-1,1-dimethyl- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 172.6±7.0 °C at 760 mmHg
Vapour Pressure: 1.8±0.3 mmHg at 25°C
Enthalpy of Vaporization: 39.2±3.0 kJ/mol
Flash Point: 50.7±26.0 °C
Index of Refraction: 1.565
Molar Refractivity: 38.2±0.5 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.34
ACD/LogD (pH 5.5): 2.63
ACD/BCF (pH 5.5): 58.92
ACD/KOC (pH 5.5): 643.83
ACD/LogD (pH 7.4): 2.63
ACD/BCF (pH 7.4): 58.92
ACD/KOC (pH 7.4): 643.83
Polar Surface Area: 44 Å2
Polarizability: 15.1±0.5 10-24cm3
Surface Tension: 32.3±7.0 dyne/cm
Molar Volume: 117.3±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement