ChemSpider 2D Image | 3-(4-Chloro-3-nitrophenyl)-1,1-diisopropylurea | C13H18ClN3O3

3-(4-Chloro-3-nitrophenyl)-1,1-diisopropylurea

  • Molecular FormulaC13H18ClN3O3
  • Average mass299.753 Da
  • Monoisotopic mass299.103668 Da
  • ChemSpider ID35141788

More details:

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

3-(4-Chlor-3-nitrophenyl)-1,1-diisopropylharnstoff [German] [ACD/IUPAC Name]
3-(4-Chloro-3-nitrophenyl)-1,1-diisopropylurea [ACD/IUPAC Name]
3-(4-Chloro-3-nitrophényl)-1,1-diisopropylurée [French] [ACD/IUPAC Name]
Urea, N'-(4-chloro-3-nitrophenyl)-N,N-bis(1-methylethyl)- [ACD/Index Name]
1-(4-chloro-3-nitrophenyl)-3,3-bis(propan-2-yl)urea
1980053-66-4 [RN]
MFCD28987631
N'-(4-Chloro-3-nitrophenyl)-N,N-diisopropylurea
N-(4-Chloro-3-nitrophenyl)-N,N-diisopropylurea

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 447.8±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.6±3.0 kJ/mol
    Flash Point: 224.6±28.7 °C
    Index of Refraction: 1.580
    Molar Refractivity: 78.8±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.91
    ACD/LogD (pH 5.5): 3.50
    ACD/BCF (pH 5.5): 270.91
    ACD/KOC (pH 5.5): 1918.75
    ACD/LogD (pH 7.4): 3.50
    ACD/BCF (pH 7.4): 270.89
    ACD/KOC (pH 7.4): 1918.64
    Polar Surface Area: 78 Å2
    Polarizability: 31.2±0.5 10-24cm3
    Surface Tension: 47.5±3.0 dyne/cm
    Molar Volume: 236.8±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement