ChemSpider 2D Image | (4R,5R)-4-methylaminorex | C10H12N2O

(4R,5R)-4-methylaminorex

  • Molecular FormulaC10H12N2O
  • Average mass176.215 Da
  • Monoisotopic mass176.094955 Da
  • ChemSpider ID21251989

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4R,5R)-4-Methyl-5-phenyl-4,5-dihydro-1,3-oxazol-2-amin [German] [ACD/IUPAC Name]
(4R,5R)-4-Methyl-5-phenyl-4,5-dihydro-1,3-oxazol-2-amine [ACD/IUPAC Name]
(4R,5R)-4-Méthyl-5-phényl-4,5-dihydro-1,3-oxazol-2-amine [French] [ACD/IUPAC Name]
(4R,5R)-4-methylaminorex
10189-63-6 [RN]
2-Oxazolamine, 4,5-dihydro-4-methyl-5-phenyl-, (4R,5R)- [ACD/Index Name]
4-METHYLAMINOREX, (4R,5R)-
4-METHYLAMINOREX, (4R-TRANS)-

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

II4E31003P [DBID]
UNII:II4E31003P [DBID]
UNII-II4E31003P [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 295.6±43.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.5±3.0 kJ/mol
Flash Point: 132.6±28.2 °C
Index of Refraction: 1.609
Molar Refractivity: 49.7±0.5 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.62
ACD/LogD (pH 5.5): -0.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.01
ACD/LogD (pH 7.4): 0.69
ACD/BCF (pH 7.4): 1.21
ACD/KOC (pH 7.4): 22.42
Polar Surface Area: 48 Å2
Polarizability: 19.7±0.5 10-24cm3
Surface Tension: 43.8±7.0 dyne/cm
Molar Volume: 143.6±7.0 cm3

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