Found 75 results

Search term: MF = 'C_{14}H_{9}BrO_{2}S'
ChemSpider 2D Image | (3E)-6-Bromo-3-(3-thienylmethylene)-2,3-dihydro-4H-chromen-4-one | C14H9BrO2S

(3E)-6-Bromo-3-(3-thienylmethylene)-2,3-dihydro-4H-chromen-4-one

  • Molecular FormulaC14H9BrO2S
  • Average mass321.189 Da
  • Monoisotopic mass319.950653 Da
  • ChemSpider ID22876975

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E)-6-Brom-3-(3-thienylmethylen)-2,3-dihydro-4H-chromen-4-on [German] [ACD/IUPAC Name]
(3E)-6-Bromo-3-(3-thienylmethylene)-2,3-dihydro-4H-chromen-4-one [ACD/IUPAC Name]
(3E)-6-Bromo-3-(3-thiénylméthylène)-2,3-dihydro-4H-chromén-4-one [French] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 6-bromo-2,3-dihydro-3-(3-thienylmethylene)-, (3E)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 477.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.1±3.0 kJ/mol
Flash Point: 242.5±28.7 °C
Index of Refraction: 1.708
Molar Refractivity: 76.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.93
ACD/LogD (pH 5.5): 4.32
ACD/BCF (pH 5.5): 1132.89
ACD/KOC (pH 5.5): 5343.04
ACD/LogD (pH 7.4): 4.32
ACD/BCF (pH 7.4): 1132.89
ACD/KOC (pH 7.4): 5343.04
Polar Surface Area: 55 Å2
Polarizability: 30.5±0.5 10-24cm3
Surface Tension: 61.2±3.0 dyne/cm
Molar Volume: 197.3±3.0 cm3

Click to predict properties on the Chemicalize site


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