ChemSpider 2D Image | (2S)-2-Hydroxy-2-(4-methylphenyl)propanoic acid | C10H12O3

(2S)-2-Hydroxy-2-(4-methylphenyl)propanoic acid

  • Molecular FormulaC10H12O3
  • Average mass180.201 Da
  • Monoisotopic mass180.078644 Da
  • ChemSpider ID23014420

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-Hydroxy-2-(4-methylphenyl)propanoic acid [ACD/IUPAC Name]
(2S)-2-Hydroxy-2-(4-methylphenyl)propansäure [German] [ACD/IUPAC Name]
162050-73-9 [RN]
Acide (2S)-2-hydroxy-2-(4-méthylphényl)propanoïque [French] [ACD/IUPAC Name]
Benzeneacetic acid, α-hydroxy-α,4-dimethyl-, (αS)- [ACD/Index Name]
(2S)-2-hydroxy-2-(p-tolyl)propanoic acid
(S)-2-Hydroxy-2-(p-tolyl)propanoic acid
(S)-2-hydroxy-2-methyl (4-methyl benzene)acetic acid
(S)-2-hydroxy-2-methyl (4-methylbenzene)acetic acid
(S)-2-HYDROXY-2-METHYL(4-METHYLBENZENE)ACETIC ACID
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 342.7±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.9±3.0 kJ/mol
Flash Point: 175.2±20.2 °C
Index of Refraction: 1.561
Molar Refractivity: 47.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.73
ACD/LogD (pH 5.5): -0.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.97
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 58 Å2
Polarizability: 19.0±0.5 10-24cm3
Surface Tension: 49.0±3.0 dyne/cm
Molar Volume: 148.0±3.0 cm3

Click to predict properties on the Chemicalize site


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