ChemSpider 2D Image | (S)-mazindol | C16H13ClN2O

(S)-mazindol

  • Molecular FormulaC16H13ClN2O
  • Average mass284.740 Da
  • Monoisotopic mass284.071655 Da
  • ChemSpider ID34989572
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(5S)-5-(4-Chlorophenyl)-2,5-dihydro-3H-imidazo[2,1-a]isoindol-5-ol [ACD/IUPAC Name]
(5S)-5-(4-Chlorophényl)-2,5-dihydro-3H-imidazo[2,1-a]isoindol-5-ol [French] [ACD/IUPAC Name]
(5S)-5-(4-Chlorphenyl)-2,5-dihydro-3H-imidazo[2,1-a]isoindol-5-ol [German] [ACD/IUPAC Name]
(S)-mazindol
1337994-13-4 [RN]
3H-Imidazo[2,1-a]isoindol-5-ol, 5-(4-chlorophenyl)-2,5-dihydro-, (5S)- [ACD/Index Name]
22232-71-9 [RN]
244-857-0 [EINECS]
MAZINDOL, (S)-
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

B99NL08Q65 [DBID]
UNII:B99NL08Q65 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 454.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.3±3.0 kJ/mol
Flash Point: 228.9±31.5 °C
Index of Refraction: 1.705
Molar Refractivity: 79.1±0.5 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.28
ACD/LogD (pH 5.5): -0.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.69
ACD/LogD (pH 7.4): -0.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.70
Polar Surface Area: 36 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 55.7±7.0 dyne/cm
Molar Volume: 203.6±7.0 cm3

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