ChemSpider 2D Image | (S)-8-(trifluoromethyl)chroman-4-amine | C10H10F3NO

(S)-8-(trifluoromethyl)chroman-4-amine

  • Molecular FormulaC10H10F3NO
  • Average mass217.188 Da
  • Monoisotopic mass217.071442 Da
  • ChemSpider ID24597893

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4S)-8-(Trifluormethyl)-4-chromanamin [German] [ACD/IUPAC Name]
(4S)-8-(Trifluoromethyl)-4-chromanamine [ACD/IUPAC Name]
(4S)-8-(Trifluorométhyl)-4-chromanamine [French] [ACD/IUPAC Name]
(4S)-8-(Trifluoromethyl)chroman-4-amine
(S)-8-(trifluoromethyl)chroman-4-amine
1228569-07-0 [RN]
2H-1-Benzopyran-4-amine, 3,4-dihydro-8-(trifluoromethyl)-, (4S)- [ACD/Index Name]
(4S)-8-(trifluoromethyl)-3,4-dihydro-2H-1-benzopyran-4-amine
(4S)-8-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-amine
(S)-8-(Trifluoromethyl)chroman-4-ylamine
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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: 1.3±0.1 g/cm3
    Boiling Point: 235.6±40.0 °C at 760 mmHg
    Vapour Pressure: 0.1±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 47.2±3.0 kJ/mol
    Flash Point: 96.3±27.3 °C
    Index of Refraction: 1.489
    Molar Refractivity: 48.6±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.39
    ACD/LogD (pH 5.5): -0.69
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.96
    ACD/BCF (pH 7.4): 1.78
    ACD/KOC (pH 7.4): 26.70
    Polar Surface Area: 35 Å2
    Polarizability: 19.3±0.5 10-24cm3
    Surface Tension: 33.5±3.0 dyne/cm
    Molar Volume: 168.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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