ChemSpider 2D Image | tert-butyl 6-amino-7-chloro-1,2,3,4-tetrahydroisoquinoline-2-carboxylate | C14H19ClN2O2

tert-butyl 6-amino-7-chloro-1,2,3,4-tetrahydroisoquinoline-2-carboxylate

  • Molecular FormulaC14H19ClN2O2
  • Average mass282.766 Da
  • Monoisotopic mass282.113495 Da
  • ChemSpider ID28474026

More details:

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

1,1-Dimethylethyl 6-amino-7-chloro-3,4-dihydro-2(1H)-isoquinolinecarboxylate
2(1H)-Isoquinolinecarboxylic acid, 6-amino-7-chloro-3,4-dihydro-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 6-amino-7-chloro-3,4-dihydro-2(1H)-isoquinolinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-6-amino-7-chlor-3,4-dihydro-2(1H)-isochinolincarboxylat [German] [ACD/IUPAC Name]
6-Amino-7-chloro-3,4-dihydro-2(1H)-isoquinoléinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
912846-75-4 [RN]
tert-butyl 6-amino-7-chloro-1,2,3,4-tetrahydroisoquinoline-2-carboxylate
[912846-75-4] [RN]
2-N-Boc- 6-amino-7-chloro-3,4-dihydroisoquinoline
MFCD18157615 [MDL number]
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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: 407.5±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 65.9±3.0 kJ/mol
    Flash Point: 200.3±28.7 °C
    Index of Refraction: 1.578
    Molar Refractivity: 75.9±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.63
    ACD/LogD (pH 5.5): 3.18
    ACD/BCF (pH 5.5): 153.19
    ACD/KOC (pH 5.5): 1275.63
    ACD/LogD (pH 7.4): 3.18
    ACD/BCF (pH 7.4): 153.27
    ACD/KOC (pH 7.4): 1276.34
    Polar Surface Area: 56 Å2
    Polarizability: 30.1±0.5 10-24cm3
    Surface Tension: 49.3±3.0 dyne/cm
    Molar Volume: 228.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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