ChemSpider 2D Image | (2S)-2-[(2R)-2-Isopropyl-2,3-dihydro-1H-inden-5-yl]propanoic acid | C15H20O2

(2S)-2-[(2R)-2-Isopropyl-2,3-dihydro-1H-inden-5-yl]propanoic acid

  • Molecular FormulaC15H20O2
  • Average mass232.318 Da
  • Monoisotopic mass232.146332 Da
  • ChemSpider ID34257607

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S)-2-[(2R)-2-Isopropyl-2,3-dihydro-1H-inden-5-yl]propanoic acid [ACD/IUPAC Name]
(2S)-2-[(2R)-2-Isopropyl-2,3-dihydro-1H-inden-5-yl]propansäure [German] [ACD/IUPAC Name]
1H-Indene-5-acetic acid, 2,3-dihydro-α-methyl-2-(1-methylethyl)-, (αS,2R)- [ACD/Index Name]
Acide (2S)-2-[(2R)-2-isopropyl-2,3-dihydro-1H-indén-5-yl]propanoïque [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 361.7±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.1±3.0 kJ/mol
Flash Point: 258.6±14.4 °C
Index of Refraction: 1.545
Molar Refractivity: 68.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.34
ACD/LogD (pH 5.5): 3.17
ACD/BCF (pH 5.5): 80.69
ACD/KOC (pH 5.5): 385.42
ACD/LogD (pH 7.4): 1.37
ACD/BCF (pH 7.4): 1.29
ACD/KOC (pH 7.4): 6.14
Polar Surface Area: 37 Å2
Polarizability: 27.0±0.5 10-24cm3
Surface Tension: 41.7±3.0 dyne/cm
Molar Volume: 215.3±3.0 cm3

Click to predict properties on the Chemicalize site


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