ChemSpider 2D Image | Methyl (2Z)-2-[(2,5-difluorophenyl)sulfonyl]-3-(dimethylamino)acrylate | C12H13F2NO4S

Methyl (2Z)-2-[(2,5-difluorophenyl)sulfonyl]-3-(dimethylamino)acrylate

  • Molecular FormulaC12H13F2NO4S
  • Average mass305.298 Da
  • Monoisotopic mass305.053345 Da
  • ChemSpider ID34967760

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-[(2,5-Difluorophényl)sulfonyl]-3-(diméthylamino)acrylate de méthyle [French] [ACD/IUPAC Name]
2-Propenoic acid, 2-[(2,5-difluorophenyl)sulfonyl]-3-(dimethylamino)-, methyl ester, (2Z)- [ACD/Index Name]
Methyl (2Z)-2-[(2,5-difluorophenyl)sulfonyl]-3-(dimethylamino)acrylate [ACD/IUPAC Name]
Methyl-(2Z)-2-[(2,5-difluorphenyl)sulfonyl]-3-(dimethylamino)acrylat [German] [ACD/IUPAC Name]
(Z)-methyl 2-((2,5-difluorophenyl)sulfonyl)-3-(dimethylamino)acrylate
[1327174-92-4] [RN]
1327174-92-4 [RN]
2-(2,5-Difluoro-benzenesulfonyl)-3-dimethylamino-acrylic acid methyl ester
BS-9947
methyl (Z)-2-(2,5-difluorophenyl)sulfonyl-3-(dimethylamino)prop-2-enoate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 426.5±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.1±3.0 kJ/mol
    Flash Point: 211.7±28.7 °C
    Index of Refraction: 1.522
    Molar Refractivity: 69.0±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.43
    ACD/LogD (pH 5.5): 1.41
    ACD/BCF (pH 5.5): 6.93
    ACD/KOC (pH 5.5): 139.12
    ACD/LogD (pH 7.4): 1.41
    ACD/BCF (pH 7.4): 6.93
    ACD/KOC (pH 7.4): 139.12
    Polar Surface Area: 72 Å2
    Polarizability: 27.4±0.5 10-24cm3
    Surface Tension: 41.4±3.0 dyne/cm
    Molar Volume: 226.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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