Found 24 results

Search term: MF = 'C_{34}H_{22}O_{4}'
ChemSpider 2D Image | (7R)-7,8-Dihydrobenzo[pqr]tetraphene-7,8-diyl dibenzoate | C34H22O4

(7R)-7,8-Dihydrobenzo[pqr]tetraphene-7,8-diyl dibenzoate

  • Molecular FormulaC34H22O4
  • Average mass494.536 Da
  • Monoisotopic mass494.151794 Da
  • ChemSpider ID58785259

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(7R)-7,8-Dihydrobenzo[pqr]tetraphen-7,8-diyl-dibenzoat [German] [ACD/IUPAC Name]
(7R)-7,8-Dihydrobenzo[pqr]tetraphene-7,8-diyl dibenzoate [ACD/IUPAC Name]
Benzo[a]pyrene-7,8-diol, 7,8-dihydro-, dibenzoate, (7R)- [ACD/Index Name]
Dibenzoate de (7R)-7,8-dihydrobenzo[pqr]tétraphène-7,8-diyle [French] [ACD/IUPAC Name]
57405-08-0 [RN]
trans-7,8-Dihydroxy-7,8-dihydrobenzo[a]pyrene Dibenzoate

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 692.0±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 101.4±3.0 kJ/mol
    Flash Point: 358.3±29.9 °C
    Index of Refraction: 1.772
    Molar Refractivity: 150.4±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 1
    ACD/LogP: 9.21
    ACD/LogD (pH 5.5): 8.47
    ACD/BCF (pH 5.5): 1000000.00
    ACD/KOC (pH 5.5): 964806.75
    ACD/LogD (pH 7.4): 8.47
    ACD/BCF (pH 7.4): 1000000.00
    ACD/KOC (pH 7.4): 964806.75
    Polar Surface Area: 53 Å2
    Polarizability: 59.6±0.5 10-24cm3
    Surface Tension: 69.0±5.0 dyne/cm
    Molar Volume: 361.3±5.0 cm3

    Click to predict properties on the Chemicalize site


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