ChemSpider 2D Image | [(3R,5S)-5-(Hydroxymethyl)-3-pyrrolidinyl]carbamic acid | C6H12N2O3

[(3R,5S)-5-(Hydroxymethyl)-3-pyrrolidinyl]carbamic acid

  • Molecular FormulaC6H12N2O3
  • Average mass160.171 Da
  • Monoisotopic mass160.084793 Da
  • ChemSpider ID32055325

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

[(3R,5S)-5-(Hydroxymethyl)-3-pyrrolidinyl]carbamic acid [ACD/IUPAC Name]
[(3R,5S)-5-(Hydroxymethyl)-3-pyrrolidinyl]carbamidsäure [German] [ACD/IUPAC Name]
[(3R,5S)-5-(hydroxymethyl)pyrrolidin-3-yl]carbamic acid
1264243-44-8 [RN]
Acide [(3R,5S)-5-(hydroxyméthyl)-3-pyrrolidinyl]carbamique [French] [ACD/IUPAC Name]
Carbamic acid, N-[(3R,5S)-5-(hydroxymethyl)-3-pyrrolidinyl]- [ACD/Index Name]
((3R,5S)-5-(Hydroxymethyl)pyrrolidin-3-yl)carbamic acid
((3R,5S)-5-(HydroxyMethyl)pyrrolidin-3-yl)carbaMicacid
1923194-69-7 [RN]
MFCD28101740

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.558
    Molar Refractivity: 38.2±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 4
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -1.91
    ACD/LogD (pH 5.5): -3.96
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.95
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 82 Å2
    Polarizability: 15.2±0.5 10-24cm3
    Surface Tension: 61.8±5.0 dyne/cm
    Molar Volume: 118.5±5.0 cm3

    Click to predict properties on the Chemicalize site


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