ChemSpider 2D Image | (3-cyclohexyl-1,2,4-oxadiazol-5-yl)methanamine | C9H15N3O

(3-cyclohexyl-1,2,4-oxadiazol-5-yl)methanamine

  • Molecular FormulaC9H15N3O
  • Average mass181.235 Da
  • Monoisotopic mass181.121506 Da
  • ChemSpider ID21800473

More details:






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

(3-cyclohexyl-1,2,4-oxadiazol-5-yl)methanamine
1-(3-Cyclohexyl-1,2,4-oxadiazol-5-yl)methanamin [German] [ACD/IUPAC Name]
1-(3-Cyclohexyl-1,2,4-oxadiazol-5-yl)methanamine [ACD/IUPAC Name]
1-(3-Cyclohexyl-1,2,4-oxadiazol-5-yl)méthanamine [French] [ACD/IUPAC Name]
1,2,4-Oxadiazole-5-methanamine, 3-cyclohexyl- [ACD/Index Name]
MFCD11125624 [MDL number]
(3-cyclohexyl-1,2,4-oxadiazol-5-yl)methylamine
(3-Cyclohexyl-1,2,4-oxadiazol-5-yl)methylamine hydrochloride
1039837-72-3 [RN]

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

MFCD12027095 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 315.7±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.7±3.0 kJ/mol
Flash Point: 144.7±28.4 °C
Index of Refraction: 1.526
Molar Refractivity: 49.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.09
ACD/LogD (pH 5.5): -0.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.09
ACD/LogD (pH 7.4): 0.81
ACD/BCF (pH 7.4): 2.37
ACD/KOC (pH 7.4): 63.07
Polar Surface Area: 65 Å2
Polarizability: 19.4±0.5 10-24cm3
Surface Tension: 48.4±3.0 dyne/cm
Molar Volume: 159.9±3.0 cm3

Click to predict properties on the Chemicalize site






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