ChemSpider 2D Image | (S)-2-Hydroxy-3-methoxy-3,3-diphenylpropanoic acid | C16H16O4

(S)-2-Hydroxy-3-methoxy-3,3-diphenylpropanoic acid

  • Molecular FormulaC16H16O4
  • Average mass272.296 Da
  • Monoisotopic mass272.104858 Da
  • ChemSpider ID24541474

  • defined stereocentres - 1 of 1 defined stereocentres

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

(2S)-2-Hydroxy-3-methoxy-3,3-diphenylpropanoic acid [ACD/IUPAC Name]
(2S)-2-Hydroxy-3-methoxy-3,3-diphenylpropansäure [German] [ACD/IUPAC Name]
(S)-2-Hydroxy-3-methoxy-3,3-diphenylpropanoic acid
178306-52-0 [RN]
Acide (2S)-2-hydroxy-3-méthoxy-3,3-diphénylpropanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, α-hydroxy-β-methoxy-β-phenyl-, (αS)- [ACD/Index Name]
(S)-2-hydroxy-3-methoxy-3,3-diphenylpropanoicacid
(S)-2-Hydroxy-3-methoxy-3,3-diphenylpropionic acid
(S)-2-Hydroxy-3-Methoxy-3,3-Diphenylpropionic Acid (en)
(s)-2-hydroxyl -3-methoxy-3,3-diphenylpropanoic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [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: 430.3±45.0 °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: 158.4±22.2 °C
    Index of Refraction: 1.592
    Molar Refractivity: 73.8±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 4.10
    ACD/LogD (pH 5.5): 0.78
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 3.56
    ACD/LogD (pH 7.4): -0.19
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 67 Å2
    Polarizability: 29.3±0.5 10-24cm3
    Surface Tension: 51.8±3.0 dyne/cm
    Molar Volume: 218.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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