ChemSpider 2D Image | (E)-N-Hydroxy-1-(4-pyrimidinyl)methanimine | C5H5N3O

(E)-N-Hydroxy-1-(4-pyrimidinyl)methanimine

  • Molecular FormulaC5H5N3O
  • Average mass123.113 Da
  • Monoisotopic mass123.043259 Da
  • ChemSpider ID28548202

More details:

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

(E)-N-Hydroxy-1-(4-pyrimidinyl)methanimin [German] [ACD/IUPAC Name]
(E)-N-Hydroxy-1-(4-pyrimidinyl)methanimine [ACD/IUPAC Name]
(E)-N-Hydroxy-1-(4-pyrimidinyl)méthanimine [French] [ACD/IUPAC Name]
4-Pyrimidinecarboxaldehyde, oxime [ACD/Index Name]
1073-65-0 [RN]
50305-79-8 [RN]
N-(pyrimidin-4-ylmethylidene)hydroxylamine
Pyrimidine-4-carbaldehyde oxime

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 251.2±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 51.6±3.0 kJ/mol
Flash Point: 105.7±19.8 °C
Index of Refraction: 1.607
Molar Refractivity: 33.0±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.49
ACD/LogD (pH 5.5): 0.57
ACD/BCF (pH 5.5): 1.61
ACD/KOC (pH 5.5): 48.88
ACD/LogD (pH 7.4): 0.57
ACD/BCF (pH 7.4): 1.58
ACD/KOC (pH 7.4): 48.15
Polar Surface Area: 58 Å2
Polarizability: 13.1±0.5 10-24cm3
Surface Tension: 52.5±7.0 dyne/cm
Molar Volume: 95.7±7.0 cm3

Click to predict properties on the Chemicalize site


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