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Search term: 1082058-99-8 (Found by approved synonym)
ChemSpider 2D Image | TUG424 | C18H16O2

TUG424

  • Molecular FormulaC18H16O2
  • Average mass264.318 Da
  • Monoisotopic mass264.115021 Da
  • ChemSpider ID24688012

More details:

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

1082058-99-8 [RN]
3-(4-(o-tolylethynyl)phenyl)propanoic acid
3-{4-[(2-Methylphenyl)ethinyl]phenyl}propansäure [German] [ACD/IUPAC Name]
3-{4-[(2-Methylphenyl)ethynyl]phenyl}propanoic acid [ACD/IUPAC Name]
Acide 3-{4-[(2-méthylphényl)éthynyl]phényl}propanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, 4-[2-(2-methylphenyl)ethynyl]- [ACD/Index Name]
CAY10587
MFCD12912449
TUG424
TUG-424
More...

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

Density: 1.2±0.1 g/cm3
Boiling Point: 448.1±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 74.5±3.0 kJ/mol
Flash Point: 205.9±21.4 °C
Index of Refraction: 1.617
Molar Refractivity: 78.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.86
ACD/LogD (pH 5.5): 3.54
ACD/BCF (pH 5.5): 172.17
ACD/KOC (pH 5.5): 754.42
ACD/LogD (pH 7.4): 1.74
ACD/BCF (pH 7.4): 2.71
ACD/KOC (pH 7.4): 11.87
Polar Surface Area: 37 Å2
Polarizability: 31.3±0.5 10-24cm3
Surface Tension: 54.9±5.0 dyne/cm
Molar Volume: 225.5±5.0 cm3

Click to predict properties on the Chemicalize site


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