Found 427 results

Search term: MF = 'C_{12}H_{8}N_{2}O_{4}S'
ChemSpider 2D Image | (4-Oxo-2-thioxo-1,4-dihydro[1]benzofuro[3,2-d]pyrimidin-3(2H)-yl)acetic acid | C12H8N2O4S

(4-Oxo-2-thioxo-1,4-dihydro[1]benzofuro[3,2-d]pyrimidin-3(2H)-yl)acetic acid

  • Molecular FormulaC12H8N2O4S
  • Average mass276.268 Da
  • Monoisotopic mass276.020477 Da
  • ChemSpider ID26456647

More details:

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

(4-Oxo-2-thioxo-1,4-dihydro[1]benzofuro[3,2-d]pyrimidin-3(2H)-yl)acetic acid [ACD/IUPAC Name]
(4-Oxo-2-thioxo-1,4-dihydro[1]benzofuro[3,2-d]pyrimidin-3(2H)-yl)essigsäure [German] [ACD/IUPAC Name]
Acide (4-oxo-2-thioxo-1,4-dihydro[1]benzofuro[3,2-d]pyrimidin-3(2H)-yl)acétique [French] [ACD/IUPAC Name]
Benzofuro[3,2-d]pyrimidine-3(2H)-acetic acid, 1,4-dihydro-4-oxo-2-thioxo- [ACD/Index Name]
(4-Oxo-2-thioxo-1,4-dihydro-2H-benzo[4,5]furo[3,2-d]pyrimidin-3-yl)-acetic acid
[951304-87-3] [RN]
2-(4-oxo-2-sulfanylidene-1H-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetic acid
2-{6-oxo-4-sulfanylidene-8-oxa-3,5-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),10,12-tetraen-5-yl}acetic acid
951304-87-3 [RN]
AKOS005744133
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.7±0.1 g/cm3
    Boiling Point: 519.8±56.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 83.4±3.0 kJ/mol
    Flash Point: 268.2±31.8 °C
    Index of Refraction: 1.795
    Molar Refractivity: 69.7±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.03
    ACD/LogD (pH 5.5): -0.50
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.79
    ACD/LogD (pH 7.4): -2.10
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 115 Å2
    Polarizability: 27.6±0.5 10-24cm3
    Surface Tension: 102.8±5.0 dyne/cm
    Molar Volume: 163.7±5.0 cm3

    Click to predict properties on the Chemicalize site


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