ChemSpider 2D Image | 3-[(4-Chlorobenzyl)sulfanyl]-1-propanamine | C10H14ClNS

3-[(4-Chlorobenzyl)sulfanyl]-1-propanamine

  • Molecular FormulaC10H14ClNS
  • Average mass215.743 Da
  • Monoisotopic mass215.053543 Da
  • ChemSpider ID22524912

More details:

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

1-Propanamine, 3-[[(4-chlorophenyl)methyl]thio]- [ACD/Index Name]
3-[(4-Chlorbenzyl)sulfanyl]-1-propanamin [German] [ACD/IUPAC Name]
3-[(4-Chlorobenzyl)sulfanyl]-1-propanamine [ACD/IUPAC Name]
3-[(4-Chlorobenzyl)sulfanyl]-1-propanamine [French] [ACD/IUPAC Name]
3-{[(4-chlorophenyl)methyl]sulfanyl}propan-1-amine
99177-74-9 [RN]
3-((4-Chlorobenzyl)thio)propan-1-amine
3-[(4-chlorobenzyl)thio]-1-propanamine
3-[(4-chlorophenyl)methylsulfanyl]propan-1-amine
MFCD06213268 [MDL number]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 319.9±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.1±3.0 kJ/mol
    Flash Point: 147.2±23.7 °C
    Index of Refraction: 1.580
    Molar Refractivity: 61.5±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.73
    ACD/LogD (pH 5.5): -0.47
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.28
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 2.93
    Polar Surface Area: 51 Å2
    Polarizability: 24.4±0.5 10-24cm3
    Surface Tension: 45.1±3.0 dyne/cm
    Molar Volume: 184.9±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement