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Search term: 78441423 (Found by CSID)
ChemSpider 2D Image | 1-{4-[(1S)-1,2-Dihydroxyethyl]phenyl}ethanone | C10H12O3

1-{4-[(1S)-1,2-Dihydroxyethyl]phenyl}ethanone

  • Molecular FormulaC10H12O3
  • Average mass180.201 Da
  • Monoisotopic mass180.078644 Da
  • ChemSpider ID78441423

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-{4-[(1S)-1,2-Dihydroxyethyl]phenyl}ethanon [German] [ACD/IUPAC Name]
1-{4-[(1S)-1,2-Dihydroxyethyl]phenyl}ethanone [ACD/IUPAC Name]
1-{4-[(1S)-1,2-Dihydroxyéthyl]phényl}éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[4-[(1S)-1,2-dihydroxyethyl]phenyl]- [ACD/Index Name]
(1S)-(4-Acetylphenyl)-1,2-ethanediol

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

Density: 1.2±0.1 g/cm3
Boiling Point: 373.8±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.5±3.0 kJ/mol
Flash Point: 194.1±20.2 °C
Index of Refraction: 1.568
Molar Refractivity: 48.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.52
ACD/LogD (pH 5.5): 0.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 27.68
ACD/LogD (pH 7.4): 0.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 27.68
Polar Surface Area: 58 Å2
Polarizability: 19.4±0.5 10-24cm3
Surface Tension: 51.8±3.0 dyne/cm
Molar Volume: 149.5±3.0 cm3

Click to predict properties on the Chemicalize site


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