Found 1 result

Search term: 886364-33-6 (Found by approved synonym)
ChemSpider 2D Image | 4-Boc-7-Chloro-2,3,4,5-tetrahydro-1H-benzo[e][1,4]diazepine | C14H19ClN2O2

4-Boc-7-Chloro-2,3,4,5-tetrahydro-1H-benzo[e][1,4]diazepine

  • Molecular FormulaC14H19ClN2O2
  • Average mass282.766 Da
  • Monoisotopic mass282.113495 Da
  • ChemSpider ID21373577

More details:

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

2-Methyl-2-propanyl 7-chloro-1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-7-chlor-1,2,3,5-tetrahydro-4H-1,4-benzodiazepin-4-carboxylat [German] [ACD/IUPAC Name]
4-Boc-7-Chloro-2,3,4,5-tetrahydro-1H-benzo[e][1,4]diazepine
4H-1,4-Benzodiazepine-4-carboxylic acid, 7-chloro-1,2,3,5-tetrahydro-, 1,1-dimethylethyl ester [ACD/Index Name]
7-Chloro-1,2,3,5-tétrahydro-4H-1,4-benzodiazépine-4-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
886364-33-6 [RN]
MFCD07369868 [MDL number]
tert-Butyl 7-chloro-1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboxylate
tert-Butyl 7-chloro-2,3-dihydro-1H-benzo[e][1,4]diazepine-4(5H)-carboxylate
[886364-33-6] [RN]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 408.3±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.0±3.0 kJ/mol
    Flash Point: 200.7±28.7 °C
    Index of Refraction: 1.537
    Molar Refractivity: 75.1±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.79
    ACD/LogD (pH 5.5): 3.44
    ACD/BCF (pH 5.5): 239.44
    ACD/KOC (pH 5.5): 1744.86
    ACD/LogD (pH 7.4): 3.45
    ACD/BCF (pH 7.4): 244.99
    ACD/KOC (pH 7.4): 1785.36
    Polar Surface Area: 42 Å2
    Polarizability: 29.8±0.5 10-24cm3
    Surface Tension: 40.6±3.0 dyne/cm
    Molar Volume: 240.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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