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Search term: BCLQXYRUKGHTIT (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1-Chloro-2-methyl-2-propanyl nitrate | C4H8ClNO3

1-Chloro-2-methyl-2-propanyl nitrate

  • Molecular FormulaC4H8ClNO3
  • Average mass153.564 Da
  • Monoisotopic mass153.019272 Da
  • ChemSpider ID32993655

More details:

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

1-Chlor-2-methyl-2-propanylnitrat [German] [ACD/IUPAC Name]
1-Chloro-2-methyl-2-propanyl nitrate [ACD/IUPAC Name]
2-Propanol, 1-chloro-2-methyl-, nitrate [ACD/Index Name]
Nitrate de 1-chloro-2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
29314-18-9 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 172.6±13.0 °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: 58.2±19.8 °C
Index of Refraction: 1.443
Molar Refractivity: 33.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.89
ACD/LogD (pH 5.5): 2.49
ACD/BCF (pH 5.5): 45.69
ACD/KOC (pH 5.5): 536.69
ACD/LogD (pH 7.4): 2.49
ACD/BCF (pH 7.4): 45.69
ACD/KOC (pH 7.4): 536.69
Polar Surface Area: 55 Å2
Polarizability: 13.1±0.5 10-24cm3
Surface Tension: 34.4±3.0 dyne/cm
Molar Volume: 125.1±3.0 cm3

Click to predict properties on the Chemicalize site


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