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Search term: MYCARDPPKMGEQK (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1-(3-Chlorophenyl)-3-hydroxy-2-[(2-methyl-2-propanyl)amino]-1-propanone | C13H18ClNO2

1-(3-Chlorophenyl)-3-hydroxy-2-[(2-methyl-2-propanyl)amino]-1-propanone

  • Molecular FormulaC13H18ClNO2
  • Average mass255.740 Da
  • Monoisotopic mass255.102600 Da
  • ChemSpider ID10676259

More details:

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

1-(3-Chlorophenyl)-3-hydroxy-2-[(2-methyl-2-propanyl)amino]-1-propanone [ACD/IUPAC Name]
1-(3-Chlorophényl)-3-hydroxy-2-[(2-méthyl-2-propanyl)amino]-1-propanone [French] [ACD/IUPAC Name]
1-(3-Chlorphenyl)-3-hydroxy-2-[(2-methyl-2-propanyl)amino]-1-propanon [German] [ACD/IUPAC Name]
1-Propanone, 1-(3-chlorophenyl)-2-[(1,1-dimethylethyl)amino]-3-hydroxy- [ACD/Index Name]
2-(tert-Butylamino)-1-(3-chlorophenyl)-3-hydroxypropan-1-one
357399-43-0 [RN]
92264-81-8 [RN]
hydroxybupropione

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

Density: 1.2±0.1 g/cm3
Boiling Point: 393.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.9±3.0 kJ/mol
Flash Point: 192.0±27.9 °C
Index of Refraction: 1.537
Molar Refractivity: 69.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.17
ACD/LogD (pH 5.5): 1.82
ACD/BCF (pH 5.5): 8.90
ACD/KOC (pH 5.5): 95.01
ACD/LogD (pH 7.4): 2.65
ACD/BCF (pH 7.4): 59.44
ACD/KOC (pH 7.4): 634.10
Polar Surface Area: 49 Å2
Polarizability: 27.5±0.5 10-24cm3
Surface Tension: 41.6±3.0 dyne/cm
Molar Volume: 222.2±3.0 cm3

Click to predict properties on the Chemicalize site


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