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Search term: MF = 'C_{16}H_{14}O_{3}S'
ChemSpider 2D Image | (2E)-3-{4-[(2-Methoxyphenyl)sulfanyl]phenyl}acrylic acid | C16H14O3S

(2E)-3-{4-[(2-Methoxyphenyl)sulfanyl]phenyl}acrylic acid

  • Molecular FormulaC16H14O3S
  • Average mass286.346 Da
  • Monoisotopic mass286.066376 Da
  • ChemSpider ID21379539

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-{4-[(2-Methoxyphenyl)sulfanyl]phenyl}acrylic acid [ACD/IUPAC Name]
(2E)-3-{4-[(2-Methoxyphenyl)sulfanyl]phenyl}acrylsäure [German] [ACD/IUPAC Name]
2-Propenoic acid, 3-[4-[(2-methoxyphenyl)thio]phenyl]-, (2E)- [ACD/Index Name]
Acide (2E)-3-{4-[(2-méthoxyphényl)sulfanyl]phényl}acrylique [French] [ACD/IUPAC Name]
(2E)-3-{4-[(2-METHOXYPHENYL)SULFANYL]PHENYL}PROP-2-ENOIC ACID
(E)-3-(4-((2-Methoxyphenyl)thio)phenyl)acrylic acid
(E)-3-(4-(2-methoxyphenylthio)phenyl)acrylic acid
95%
951624-15-0 [RN]
MFCD09788616

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 463.0±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 76.3±3.0 kJ/mol
    Flash Point: 233.8±25.9 °C
    Index of Refraction: 1.649
    Molar Refractivity: 81.3±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 4.36
    ACD/LogD (pH 5.5): 2.67
    ACD/BCF (pH 5.5): 33.30
    ACD/KOC (pH 5.5): 202.28
    ACD/LogD (pH 7.4): 0.87
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.23
    Polar Surface Area: 72 Å2
    Polarizability: 32.2±0.5 10-24cm3
    Surface Tension: 58.4±5.0 dyne/cm
    Molar Volume: 223.0±5.0 cm3

    Click to predict properties on the Chemicalize site


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