Found 1345 results

Search term: MF = 'C_{15}H_{19}BrO_{3}'
ChemSpider 2D Image | 2-(2-Bromo-4-{[(1S,2S)-2-hydroxycyclopentyl]methyl}phenyl)propanoic acid | C15H19BrO3

2-(2-Bromo-4-{[(1S,2S)-2-hydroxycyclopentyl]methyl}phenyl)propanoic acid

  • Molecular FormulaC15H19BrO3
  • Average mass327.214 Da
  • Monoisotopic mass326.051758 Da
  • ChemSpider ID26354600

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

2-(2-Brom-4-{[(1S,2S)-2-hydroxycyclopentyl]methyl}phenyl)propansäure [German] [ACD/IUPAC Name]
2-(2-Bromo-4-{[(1S,2S)-2-hydroxycyclopentyl]methyl}phenyl)propanoic acid [ACD/IUPAC Name]
Acide 2-(2-bromo-4-{[(1S,2S)-2-hydroxycyclopentyl]méthyl}phényl)propanoïque [French] [ACD/IUPAC Name]
Benzeneacetic acid, 2-bromo-4-[[(1S,2S)-2-hydroxycyclopentyl]methyl]-α-methyl- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 470.4±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.2±3.0 kJ/mol
Flash Point: 238.3±24.6 °C
Index of Refraction: 1.603
Molar Refractivity: 77.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.16
ACD/LogD (pH 5.5): 2.11
ACD/BCF (pH 5.5): 11.26
ACD/KOC (pH 5.5): 81.93
ACD/LogD (pH 7.4): 0.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.39
Polar Surface Area: 58 Å2
Polarizability: 30.6±0.5 10-24cm3
Surface Tension: 52.5±3.0 dyne/cm
Molar Volume: 224.9±3.0 cm3

Click to predict properties on the Chemicalize site


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