Found 1 result

Search term: InChI=1S/C4H7NO4/c1-2-4(6)3-9-5(7)8/h2,4,6H,1,3H2 (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | 2-Hydroxy-3-buten-1-yl nitrate | C4H7NO4

2-Hydroxy-3-buten-1-yl nitrate

  • Molecular FormulaC4H7NO4
  • Average mass133.103 Da
  • Monoisotopic mass133.037506 Da
  • ChemSpider ID110516676

More details:

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

2-Hydroxy-3-buten-1-yl nitrate [ACD/IUPAC Name]
2-Hydroxy-3-buten-1-ylnitrat [German] [ACD/IUPAC Name]
3-Butene-1,2-diol, 1-nitrate [ACD/Index Name]
Nitrate de 2-hydroxy-3-butén-1-yle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 134.8±28.0 °C at 760 mmHg
Vapour Pressure: 3.4±0.5 mmHg at 25°C
Enthalpy of Vaporization: 43.4±6.0 kJ/mol
Flash Point: 35.3±24.0 °C
Index of Refraction: 1.466
Molar Refractivity: 29.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.90
ACD/LogD (pH 5.5): 0.92
ACD/BCF (pH 5.5): 2.95
ACD/KOC (pH 5.5): 75.49
ACD/LogD (pH 7.4): 0.92
ACD/BCF (pH 7.4): 2.95
ACD/KOC (pH 7.4): 75.49
Polar Surface Area: 75 Å2
Polarizability: 11.7±0.5 10-24cm3
Surface Tension: 42.7±3.0 dyne/cm
Molar Volume: 106.7±3.0 cm3

Click to predict properties on the Chemicalize site


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