ChemSpider 2D Image | (2S)-2-(4-Isobutylphenyl)propanoic acid - D-lysine (1:1) | C19H32N2O4

(2S)-2-(4-Isobutylphenyl)propanoic acid - D-lysine (1:1)

  • Molecular FormulaC19H32N2O4
  • Average mass352.468 Da
  • Monoisotopic mass352.236206 Da
  • ChemSpider ID18656552

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-(4-Isobutylphenyl)propanoic acid - D-lysine (1:1) [ACD/IUPAC Name]
(2S)-2-(4-Isobutylphenyl)propansäure --D-lysin (1:1) [German] [ACD/IUPAC Name]
D-Lysine - acide (2S)-2-(4-isobutylphényl)propanoïque (1:1) [French] [ACD/IUPAC Name]
D-Lysine, compd. with (αS)-α-methyl-4-(2-methylpropyl)benzeneacetic acid (1:1) [ACD/Index Name]
(S)-(+)-IBUPROFEN, (S)-(+)-LYSINATE
113403-10-4 [RN]

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

Density:
Boiling Point: 549.7±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 87.3±0.0 kJ/mol
Flash Point: 286.2±0.0 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 6
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 2.69
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 127 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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