Found 1889 results

Search term: MF = 'C_{12}H_{9}BrN_{2}O_{2}'
ChemSpider 2D Image | (2E)-3-[4-(4-Bromo-1H-pyrazol-1-yl)phenyl]acrylic acid | C12H9BrN2O2

(2E)-3-[4-(4-Bromo-1H-pyrazol-1-yl)phenyl]acrylic acid

  • Molecular FormulaC12H9BrN2O2
  • Average mass293.116 Da
  • Monoisotopic mass291.984741 Da
  • ChemSpider ID29304434

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-[4-(4-Brom-1H-pyrazol-1-yl)phenyl]acrylsäure [German] [ACD/IUPAC Name]
(2E)-3-[4-(4-Bromo-1H-pyrazol-1-yl)phenyl]acrylic acid [ACD/IUPAC Name]
2-Propenoic acid, 3-[4-(4-bromo-1H-pyrazol-1-yl)phenyl]-, (2E)- [ACD/Index Name]
Acide (2E)-3-[4-(4-bromo-1H-pyrazol-1-yl)phényl]acrylique [French] [ACD/IUPAC Name]
(2E)-3-[4-(4-bromo-1H-pyrazol-1-yl)phenyl]prop-2-enoic acid
(2E)-3-[4-(4-BROMOPYRAZOL-1-YL)PHENYL]PROP-2-ENOIC ACID
(E)-3-(4-(4-bromo-1H-pyrazol-1-yl)phenyl)acrylic acid
(E)-3-[4-(4-bromopyrazol-1-yl)phenyl]prop-2-enoic acid
1216366-99-2 [RN]
3-[4-(4-Bromo-1H-pyrazol-1-yl)phenyl]acrylic acid
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 450.0±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.7±3.0 kJ/mol
Flash Point: 225.9±24.6 °C
Index of Refraction: 1.641
Molar Refractivity: 69.0±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.43
ACD/LogD (pH 5.5): 1.32
ACD/BCF (pH 5.5): 2.81
ACD/KOC (pH 5.5): 30.36
ACD/LogD (pH 7.4): -0.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 55 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 53.1±7.0 dyne/cm
Molar Volume: 191.4±7.0 cm3

Click to predict properties on the Chemicalize site


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