ChemSpider 2D Image | (6R)-N~6~-[(3,3,3-~2~H_3_)Propyl]-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamine | C10H14D3N3S

(6R)-N6-[(3,3,3-2H3)Propyl]-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamine

  • Molecular FormulaC10H14D3N3S
  • Average mass214.346 Da
  • Monoisotopic mass214.133148 Da
  • ChemSpider ID48063118

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(6R)-N6-[(3,3,3-2H3)Propyl]-4,5,6,7-tetrahydro-1,3-benzothiazol-2,6-diamin [German] [ACD/IUPAC Name]
(6R)-N6-[(3,3,3-2H3)Propyl]-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamine [ACD/IUPAC Name]
(6R)-N6-[(3,3,3-2H3)Propyl]-4,5,6,7-tétrahydro-1,3-benzothiazole-2,6-diamine [French] [ACD/IUPAC Name]
2,6-Benzothiazolediamine, 4,5,6,7-tetrahydro-N6-(propyl-3,3,3-d3)-, (6R)- [ACD/Index Name]
(6R)-6-N-(3,3,3-trideuteriopropyl)-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamine
1330277-55-8 [RN]
1432230-09-5 [RN]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 378.0±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 62.6±3.0 kJ/mol
    Flash Point: 182.4±27.9 °C
    Index of Refraction: 1.583
    Molar Refractivity: 60.3±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 3
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.42
    ACD/LogD (pH 5.5): -1.46
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.30
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 2.09
    Polar Surface Area: 79 Å2
    Polarizability: 23.9±0.5 10-24cm3
    Surface Tension: 53.2±5.0 dyne/cm
    Molar Volume: 180.5±5.0 cm3

    Click to predict properties on the Chemicalize site


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