ChemSpider 2D Image | 5-((tert-Butoxycarbonyl)amino)-4-oxopentanoic acid | C10H17NO5

5-((tert-Butoxycarbonyl)amino)-4-oxopentanoic acid

  • Molecular FormulaC10H17NO5
  • Average mass231.246 Da
  • Monoisotopic mass231.110672 Da
  • ChemSpider ID16485532

More details:

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

5-((tert-Butoxycarbonyl)amino)-4-oxopentanoic acid
5-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-4-oxopentanoic acid [ACD/IUPAC Name]
5-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-4-oxopentansäure [German] [ACD/IUPAC Name]
5-[(TERT-BUTOXYCARBONYL)AMINO]-4-OXOPENTANOIC ACID
5-{[(TERT-BUTOXY)CARBONYL]AMINO}-4-OXOPENTANOIC ACID
72072-06-1 [RN]
Acide 5-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)-4-oxopentanoïque [French] [ACD/IUPAC Name]
Pentanoic acid, 5-[[(1,1-dimethylethoxy)carbonyl]amino]-4-oxo- [ACD/Index Name]
[72072-06-1] [RN]
6,7-Dimethoxy-3,4-dihydronaphthalen-2(1H)-one
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 401.5±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 71.6±6.0 kJ/mol
    Flash Point: 196.6±23.2 °C
    Index of Refraction: 1.471
    Molar Refractivity: 55.3±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 0.85
    ACD/LogD (pH 5.5): -0.46
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 4.84
    ACD/LogD (pH 7.4): -2.26
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 93 Å2
    Polarizability: 21.9±0.5 10-24cm3
    Surface Tension: 42.5±3.0 dyne/cm
    Molar Volume: 197.7±3.0 cm3

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