ChemSpider 2D Image | 2-(3-((tert-Butoxycarbonyl)amino)pyrrolidin-1-yl)-2-(1H-indol-2-yl)acetic acid | C19H25N3O4

2-(3-((tert-Butoxycarbonyl)amino)pyrrolidin-1-yl)-2-(1H-indol-2-yl)acetic acid

  • Molecular FormulaC19H25N3O4
  • Average mass359.419 Da
  • Monoisotopic mass359.184509 Da
  • ChemSpider ID29365366

More details:

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

1H-Indol-2-yl[3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-1-pyrrolidinyl]acetic acid [ACD/IUPAC Name]
1H-Indol-2-yl[3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-1-pyrrolidinyl]essigsäure [German] [ACD/IUPAC Name]
1H-Indole-2-acetic acid, α-[3-[[(1,1-dimethylethoxy)carbonyl]amino]-1-pyrrolidinyl]- [ACD/Index Name]
2-(3-((tert-Butoxycarbonyl)amino)pyrrolidin-1-yl)-2-(1H-indol-2-yl)acetic acid
885276-31-3 [RN]
Acide 1H-indol-2-yl[3-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)-1-pyrrolidinyl]acétique [French] [ACD/IUPAC Name]
(3-BOC-AMINO-PYRROLIDIN-1-YL)-(1H-INDOL-2-YL)-ACETIC ACID
(3-BOC-AMINO-PYRROLIDIN-1-YL)-(1H-INDOL-2-YL)-ACETICACID
[885276-31-3] [RN]
{3-[(TERT-BUTOXYCARBONYL)AMINO]PYRROLIDIN-1-YL}(1H-INDOL-2-YL)ACETIC ACID
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 557.2±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 88.3±3.0 kJ/mol
    Flash Point: 290.8±30.1 °C
    Index of Refraction: 1.624
    Molar Refractivity: 98.1±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 3
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 2.75
    ACD/LogD (pH 5.5): 0.14
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 2.05
    ACD/LogD (pH 7.4): 0.13
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 2.03
    Polar Surface Area: 95 Å2
    Polarizability: 38.9±0.5 10-24cm3
    Surface Tension: 60.8±5.0 dyne/cm
    Molar Volume: 277.8±5.0 cm3

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