Found 3371 results

Search term: MF = 'C_{15}H_{20}ClNO_{4}'
ChemSpider 2D Image | 4-Chloro-N-methyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}phenylalanine | C15H20ClNO4

4-Chloro-N-methyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}phenylalanine

  • Molecular FormulaC15H20ClNO4
  • Average mass313.777 Da
  • Monoisotopic mass313.108093 Da
  • ChemSpider ID18823511

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

4-Chlor-N-methyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}phenylalanin [German] [ACD/IUPAC Name]
4-Chloro-N-methyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}phenylalanine [ACD/IUPAC Name]
4-Chloro-N-méthyl-N-{[(2-méthyl-2-propanyl)oxy]carbonyl}phénylalanine [French] [ACD/IUPAC Name]
Phenylalanine, 4-chloro-N-[(1,1-dimethylethoxy)carbonyl]-N-methyl- [ACD/Index Name]
(2S)-2-[(TERT-BUTOXYCARBONYL)(METHYL)AMINO]-3-(4-CHLOROPHENYL)PROPANOIC ACID
(2S)-2-{[(TERT-BUTOXY)CARBONYL](METHYL)AMINO}-3-(4-CHLOROPHENYL)PROPANOIC ACID
(2S)-3-(4-chlorophenyl)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid
(S)-2-((tert-Butoxycarbonyl)(methyl)amino)-3-(4-chlorophenyl)propanoic acid
[179033-68-2] [RN]
125324-00-7 [RN]
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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: 430.8±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 72.3±3.0 kJ/mol
    Flash Point: 214.3±27.3 °C
    Index of Refraction: 1.539
    Molar Refractivity: 80.1±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 4.05
    ACD/LogD (pH 5.5): 1.65
    ACD/BCF (pH 5.5): 3.37
    ACD/KOC (pH 5.5): 21.38
    ACD/LogD (pH 7.4): 0.17
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 67 Å2
    Polarizability: 31.8±0.5 10-24cm3
    Surface Tension: 45.3±3.0 dyne/cm
    Molar Volume: 255.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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