ChemSpider 2D Image | (2E)-3-[3,4-Bis(benzyloxy)phenyl]-2-[4-(2-naphthyl)-1,3-thiazol-2-yl]acrylonitrile | C36H26N2O2S

(2E)-3-[3,4-Bis(benzyloxy)phenyl]-2-[4-(2-naphthyl)-1,3-thiazol-2-yl]acrylonitrile

  • Molecular FormulaC36H26N2O2S
  • Average mass550.669 Da
  • Monoisotopic mass550.171509 Da
  • ChemSpider ID4775698

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-[3,4-Bis(benzyloxy)phenyl]-2-[4-(2-naphthyl)-1,3-thiazol-2-yl]acrylonitril [German] [ACD/IUPAC Name]
(2E)-3-[3,4-Bis(benzyloxy)phenyl]-2-[4-(2-naphthyl)-1,3-thiazol-2-yl]acrylonitrile [ACD/IUPAC Name]
(2E)-3-[3,4-Bis(benzyloxy)phényl]-2-[4-(2-naphtyl)-1,3-thiazol-2-yl]acrylonitrile [French] [ACD/IUPAC Name]
2-Thiazoleacetonitrile, α-[[3,4-bis(phenylmethoxy)phenyl]methylene]-4-(2-naphthalenyl)-, (αE)- [ACD/Index Name]
(2E)-3-[3,4-bis(benzyloxy)phenyl]-2-[4-(naphthalen-2-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
(E)-3-(3,4-bis(benzyloxy)phenyl)-2-(4-(naphthalen-2-yl)thiazol-2-yl)acrylonitrile
(E)-3-[3,4-bis(phenylmethoxy)phenyl]-2-(4-naphthalen-2-yl-1,3-thiazol-2-yl)prop-2-enenitrile
477296-34-7 [RN]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 757.0±70.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.5 mmHg at 25°C
    Enthalpy of Vaporization: 110.3±3.0 kJ/mol
    Flash Point: 411.6±35.7 °C
    Index of Refraction: 1.695
    Molar Refractivity: 168.1±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 2
    ACD/LogP: 9.82
    ACD/LogD (pH 5.5): 8.44
    ACD/BCF (pH 5.5): 1000000.00
    ACD/KOC (pH 5.5): 927758.38
    ACD/LogD (pH 7.4): 8.44
    ACD/BCF (pH 7.4): 1000000.00
    ACD/KOC (pH 7.4): 927798.13
    Polar Surface Area: 83 Å2
    Polarizability: 66.6±0.5 10-24cm3
    Surface Tension: 57.1±3.0 dyne/cm
    Molar Volume: 437.4±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement