ChemSpider 2D Image | (S)-3-amino-2-(hydroxymethyl)propanoic acid | C4H9NO3

(S)-3-amino-2-(hydroxymethyl)propanoic acid

  • Molecular FormulaC4H9NO3
  • Average mass119.119 Da
  • Monoisotopic mass119.058243 Da
  • ChemSpider ID16743752

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-3-Amino-2-(hydroxymethyl)propanoic acid [ACD/IUPAC Name]
(2S)-3-Amino-2-(hydroxymethyl)propansäure [German] [ACD/IUPAC Name]
(S)-3-amino-2-(hydroxymethyl)propanoic acid
(S)-3-AMINO-2-(HYDROXYMETHYL)PROPIONIC ACID
930784-11-5 [RN]
Acide (2S)-3-amino-2-(hydroxyméthyl)propanoïque [French] [ACD/IUPAC Name]
MFCD15143424 [MDL number]
Propanoic acid, 3-amino-2-(hydroxymethyl)-, (2S)- [ACD/Index Name]
(2S)-2-(Aminomethyl)-3-hydroxypropanoic acid
(s)-3-amino-2-(hydroxymethyl) propanoic 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: 357.8±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 69.8±6.0 kJ/mol
    Flash Point: 170.2±25.1 °C
    Index of Refraction: 1.511
    Molar Refractivity: 27.2±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 4
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -1.75
    ACD/LogD (pH 5.5): -4.17
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -4.17
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 84 Å2
    Polarizability: 10.8±0.5 10-24cm3
    Surface Tension: 63.6±3.0 dyne/cm
    Molar Volume: 90.7±3.0 cm3

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