Found 1 result

Search term: 871232-96-1 (Found by approved synonym)
ChemSpider 2D Image | 2,2':6',2''-Terpyridine-4'-thiol | C15H11N3S

2,2':6',2''-Terpyridine-4'-thiol

  • Molecular FormulaC15H11N3S
  • Average mass265.333 Da
  • Monoisotopic mass265.067352 Da
  • ChemSpider ID21428890

More details:

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

[2,2':6',2''-Terpyridine]-4'(1'H)-thione
[2,2':6',2''-Terpyridine]-4'-thiol [ACD/Index Name]
1010828-64-4 [RN]
2,2':6',2''-Terpyridin-4'(1'H)-thion
2,2':6',2''-Terpyridin-4'-thiol [German] [ACD/IUPAC Name]
2,2':6',2''-Terpyridine-4'(1'H)-thione
2,2':6',2''-Terpyridine-4'-thiol [ACD/IUPAC Name]
2,2':6',2''-Terpyridine-4'-thiol [French] [ACD/IUPAC Name]
4'-Mercapto-2,2':6',2''-terpyridine
871232-96-1 [RN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

E4 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 464.7±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 69.8±3.0 kJ/mol
    Flash Point: 234.9±28.7 °C
    Index of Refraction: 1.655
    Molar Refractivity: 77.9±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.43
    ACD/LogD (pH 5.5): 0.48
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 3.32
    ACD/LogD (pH 7.4): 0.46
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.18
    Polar Surface Area: 77 Å2
    Polarizability: 30.9±0.5 10-24cm3
    Surface Tension: 57.6±3.0 dyne/cm
    Molar Volume: 212.3±3.0 cm3

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