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Search term: VVHSHOSHSZLAIN (Found by InChIKey (skeleton match))
ChemSpider 2D Image | tert-butyl 8-chloro-3,4-dihydroisoquinoline-2(1H)-carboxylate | C14H18ClNO2

tert-butyl 8-chloro-3,4-dihydroisoquinoline-2(1H)-carboxylate

  • Molecular FormulaC14H18ClNO2
  • Average mass267.751 Da
  • Monoisotopic mass267.102600 Da
  • ChemSpider ID26537591

More details:

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

138350-93-3 [RN]
2(1H)-Isoquinolinecarboxylic acid, 8-chloro-3,4-dihydro-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 8-chloro-3,4-dihydro-2(1H)-isoquinolinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-8-chlor-3,4-dihydro-2(1H)-isochinolincarboxylat [German] [ACD/IUPAC Name]
8-Chloro-3,4-dihydro-2(1H)-isoquinoléinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-butyl 8-chloro-3,4-dihydroisoquinoline-2(1H)-carboxylate
3-Oxo-2-(tetrahydro-2H-pyran-4-yl)-2,3-dihydropyridazine-4-carboxylic acid
MFCD09263980
TERT-BUTYL-8-CHLORO-3,4-DIHYDROISOQUINOLINE-2(1H)-CARBOXYLATE

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: 368.3±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.5±3.0 kJ/mol
    Flash Point: 176.5±27.9 °C
    Index of Refraction: 1.546
    Molar Refractivity: 71.7±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.54
    ACD/LogD (pH 5.5): 3.94
    ACD/BCF (pH 5.5): 579.20
    ACD/KOC (pH 5.5): 3305.47
    ACD/LogD (pH 7.4): 3.94
    ACD/BCF (pH 7.4): 579.20
    ACD/KOC (pH 7.4): 3305.47
    Polar Surface Area: 30 Å2
    Polarizability: 28.4±0.5 10-24cm3
    Surface Tension: 42.5±3.0 dyne/cm
    Molar Volume: 226.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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