ChemSpider 2D Image | (5-METHYL-1,2,4-OXADIAZOL-3-YL)METHANAMINE | C4H7N3O

(5-METHYL-1,2,4-OXADIAZOL-3-YL)METHANAMINE

  • Molecular FormulaC4H7N3O
  • Average mass113.118 Da
  • Monoisotopic mass113.058914 Da
  • ChemSpider ID17817053

More details:






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

(5-METHYL-1,2,4-OXADIAZOL-3-YL)METHANAMINE
1-(5-Methyl-1,2,4-oxadiazol-3-yl)methanamin [German] [ACD/IUPAC Name]
1-(5-Methyl-1,2,4-oxadiazol-3-yl)methanamine [ACD/IUPAC Name]
1-(5-Méthyl-1,2,4-oxadiazol-3-yl)méthanamine [French] [ACD/IUPAC Name]
1,2,4-oxadiazole-3-methanamine, 5-methyl- [ACD/Index Name]
54435-03-9 [RN]
(5-methyl-1,2,4-oxadiazol-3-yl)methylamine
1,2,4-OXADIAZOLE-3-METHANAMINE,5-METHYL-
AGN-PC-015OXV
C-(5-Methyl-[1,2,4]oxadiazol-3-yl)methylamine
More...

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

MFCD08445783 [DBID]
MFCD11506367 [DBID]
  • Miscellaneous
    • Safety:

      Irritant Matrix Scientific [021314]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 223.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.0±3.0 kJ/mol
Flash Point: 88.7±27.9 °C
Index of Refraction: 1.502
Molar Refractivity: 28.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.97
ACD/LogD (pH 5.5): -1.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.55
ACD/LogD (pH 7.4): -0.84
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.24
Polar Surface Area: 65 Å2
Polarizability: 11.1±0.5 10-24cm3
Surface Tension: 50.5±3.0 dyne/cm
Molar Volume: 94.9±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement