Found 74 results

Search term: MF = 'C_{13}H_{7}BrO_{2}'
ChemSpider 2D Image | (2Z)-3-Bromo-5-(3-ethynylphenyl)-2-penten-4-ynoic acid | C13H7BrO2

(2Z)-3-Bromo-5-(3-ethynylphenyl)-2-penten-4-ynoic acid

  • Molecular FormulaC13H7BrO2
  • Average mass275.098 Da
  • Monoisotopic mass273.962921 Da
  • ChemSpider ID85263474

More details:

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

(2Z)-3-Brom-5-(3-ethinylphenyl)-2-penten-4-insäure [German] [ACD/IUPAC Name]
(2Z)-3-Bromo-5-(3-ethynylphenyl)-2-penten-4-ynoic acid [ACD/IUPAC Name]
2-Penten-4-ynoic acid, 3-bromo-5-(3-ethynylphenyl)-, (2Z)- [ACD/Index Name]
Acide (2Z)-3-bromo-5-(3-éthynylphényl)-2-pentén-4-ynoïque [French] [ACD/IUPAC 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: 398.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.5±3.0 kJ/mol
Flash Point: 194.9±27.9 °C
Index of Refraction: 1.657
Molar Refractivity: 64.0±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.93
ACD/LogD (pH 5.5): 0.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.26
ACD/LogD (pH 7.4): -0.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 37 Å2
Polarizability: 25.4±0.5 10-24cm3
Surface Tension: 67.0±5.0 dyne/cm
Molar Volume: 174.1±5.0 cm3

Click to predict properties on the Chemicalize site


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