ChemSpider 2D Image | 4-[(Benzyloxy)carbonyl]-1,4-oxazepane-2-carboxylic acid | C14H17NO5

4-[(Benzyloxy)carbonyl]-1,4-oxazepane-2-carboxylic acid

  • Molecular FormulaC14H17NO5
  • Average mass279.289 Da
  • Monoisotopic mass279.110687 Da
  • ChemSpider ID24605427

More details:

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

1,4-Oxazepine-2,4(5H)-dicarboxylic acid, tetrahydro-, 4-(phenylmethyl) ester [ACD/Index Name]
1141669-63-7 [RN]
4-[(Benzyloxy)carbonyl]-1,4-oxazepan-2-carbonsäure [German] [ACD/IUPAC Name]
4-[(Benzyloxy)carbonyl]-1,4-oxazepane-2-carboxylic acid [ACD/IUPAC Name]
Acide 4-[(benzyloxy)carbonyl]-1,4-oxazépane-2-carboxylique [French] [ACD/IUPAC Name]
[1141669-63-7] [RN]
4-((Benzyloxy)carbonyl)-1,4-oxazepane-2-carboxylic acid
4-((benzyloxy)carbonyl)-1,4-oxazepane-2-carboxylicacid
4-Cbz-2-homomorpholinecarboxylic Acid
MFCD11656816 [MDL number]
More...

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 474.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 77.7±3.0 kJ/mol
    Flash Point: 240.7±28.7 °C
    Index of Refraction: 1.557
    Molar Refractivity: 69.8±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.05
    ACD/LogD (pH 5.5): -0.93
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.29
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 76 Å2
    Polarizability: 27.7±0.5 10-24cm3
    Surface Tension: 53.7±3.0 dyne/cm
    Molar Volume: 216.9±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement