ChemSpider 2D Image | 2-Boc-7-(trifluoromethyl)-1,2,3,4-tetrahydroisoquinoline | C15H18F3NO2

2-Boc-7-(trifluoromethyl)-1,2,3,4-tetrahydroisoquinoline

  • Molecular FormulaC15H18F3NO2
  • Average mass301.304 Da
  • Monoisotopic mass301.128967 Da
  • ChemSpider ID24598216

More details:

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

1257855-77-8 [RN]
2(1H)-Isoquinolinecarboxylic acid, 3,4-dihydro-7-(trifluoromethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Boc-7-(trifluoromethyl)-1,2,3,4-tetrahydroisoquinoline
2-Methyl-2-propanyl 7-(trifluoromethyl)-3,4-dihydro-2(1H)-isoquinolinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-7-(trifluormethyl)-3,4-dihydro-2(1H)-isochinolincarboxylat [German] [ACD/IUPAC Name]
7-(Trifluorométhyl)-3,4-dihydro-2(1H)-isoquinoléinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-Butyl 7-(trifluoromethyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
[1257855-77-8] [RN]
'1257855-77-8 [EINECS]
2,4'-Dinitrdiphenylmethane
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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: 1.2±0.1 g/cm3
    Boiling Point: 334.8±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.8±3.0 kJ/mol
    Flash Point: 156.3±27.9 °C
    Index of Refraction: 1.491
    Molar Refractivity: 71.8±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.52
    ACD/LogD (pH 5.5): 4.10
    ACD/BCF (pH 5.5): 771.24
    ACD/KOC (pH 5.5): 4057.45
    ACD/LogD (pH 7.4): 4.10
    ACD/BCF (pH 7.4): 771.24
    ACD/KOC (pH 7.4): 4057.45
    Polar Surface Area: 30 Å2
    Polarizability: 28.5±0.5 10-24cm3
    Surface Tension: 34.9±3.0 dyne/cm
    Molar Volume: 248.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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