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Search term: ZMDNYIYWXSFKSQ (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 1,2,4-Oxadiazol-3-ylmethanol | C3H4N2O2

1,2,4-Oxadiazol-3-ylmethanol

  • Molecular FormulaC3H4N2O2
  • Average mass100.076 Da
  • Monoisotopic mass100.027275 Da
  • ChemSpider ID28605298

More details:






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

(1,2,4-oxadiazol-3-yl)methanol
1,2,4-Oxadiazol-3-ylmethanol [German] [ACD/IUPAC Name]
1,2,4-Oxadiazol-3-ylmethanol [ACD/IUPAC Name]
1,2,4-Oxadiazol-3-ylméthanol [French] [ACD/IUPAC Name]
1,2,4-Oxadiazole-3-methanol [ACD/Index Name]
1154990-12-1 [RN]
1,?2,?4-?Oxadiazole-?3-?methanol
MFCD12137921

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

Density: 1.4±0.1 g/cm3
Boiling Point: 234.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.7±3.0 kJ/mol
Flash Point: 95.3±27.9 °C
Index of Refraction: 1.496
Molar Refractivity: 21.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.28
ACD/LogD (pH 5.5): -0.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.25
ACD/LogD (pH 7.4): -0.95
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.25
Polar Surface Area: 59 Å2
Polarizability: 8.4±0.5 10-24cm3
Surface Tension: 61.6±3.0 dyne/cm
Molar Volume: 72.5±3.0 cm3

Click to predict properties on the Chemicalize site






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