Found 16 results

Search term: MF = 'C_{9}H_{13}BO_{4}S'
ChemSpider 2D Image | [5-(3-Ethoxy-3-oxopropyl)-3-thienyl]boronic acid | C9H13BO4S

[5-(3-Ethoxy-3-oxopropyl)-3-thienyl]boronic acid

  • Molecular FormulaC9H13BO4S
  • Average mass228.073 Da
  • Monoisotopic mass228.062759 Da
  • ChemSpider ID48069365

More details:

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

[5-(3-Ethoxy-3-oxopropyl)-3-thienyl]boronic acid [ACD/IUPAC Name]
[5-(3-Ethoxy-3-oxopropyl)-3-thienyl]borsäure [German] [ACD/IUPAC Name]
2-Thiophenepropanoic acid, 4-borono-, ethyl ester [ACD/Index Name]
Acide [5-(3-éthoxy-3-oxopropyl)-3-thiényl]boronique [French] [ACD/IUPAC Name]
(5-(3-Ethoxy-3-oxopropyl)thiophen-3-yl)boronic acid
[5-(3-ETHOXY-3-OXOPROPYL)THIOPHEN-3-YL]BORONIC ACID
2377608-83-6 [RN]
5-(3-ETHOXY-3-OXOPROPYL)THIOPHEN-3-YLBORONIC ACID
5-(3-ethoxy-3-oxopropyl)thiophene-3-boronic acid
MFCD28369567

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 388.2±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 67.2±3.0 kJ/mol
    Flash Point: 188.6±30.7 °C
    Index of Refraction: 1.531
    Molar Refractivity: 56.4±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.84
    ACD/LogD (pH 5.5): 1.82
    ACD/BCF (pH 5.5): 14.15
    ACD/KOC (pH 5.5): 231.81
    ACD/LogD (pH 7.4): 1.76
    ACD/BCF (pH 7.4): 12.29
    ACD/KOC (pH 7.4): 201.36
    Polar Surface Area: 95 Å2
    Polarizability: 22.4±0.5 10-24cm3
    Surface Tension: 48.2±5.0 dyne/cm
    Molar Volume: 182.4±5.0 cm3

    Click to predict properties on the Chemicalize site


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