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Search term: UAIVPPAGWHXQPR-ZETCQYMHSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (3S)-3-Amino-7-chloro-1-hydroxy-3,4-dihydro-2(1H)-quinolinone | C9H9ClN2O2

(3S)-3-Amino-7-chloro-1-hydroxy-3,4-dihydro-2(1H)-quinolinone

  • Molecular FormulaC9H9ClN2O2
  • Average mass212.633 Da
  • Monoisotopic mass212.035248 Da
  • ChemSpider ID28506965

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-Amino-7-chlor-1-hydroxy-3,4-dihydro-2(1H)-chinolinon [German] [ACD/IUPAC Name]
(3S)-3-Amino-7-chloro-1-hydroxy-3,4-dihydro-2(1H)-quinoléinone [French] [ACD/IUPAC Name]
(3S)-3-Amino-7-chloro-1-hydroxy-3,4-dihydro-2(1H)-quinolinone [ACD/IUPAC Name]
2(1H)-Quinolinone, 3-amino-7-chloro-3,4-dihydro-1-hydroxy-, (3S)- [ACD/Index Name]
186969-79-9 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 402.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.9±3.0 kJ/mol
Flash Point: 197.2±31.5 °C
Index of Refraction: 1.666
Molar Refractivity: 52.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.22
ACD/LogD (pH 5.5): -0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.06
ACD/LogD (pH 7.4): 0.37
ACD/BCF (pH 7.4): 1.09
ACD/KOC (pH 7.4): 35.18
Polar Surface Area: 67 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 70.0±3.0 dyne/cm
Molar Volume: 140.3±3.0 cm3

Click to predict properties on the Chemicalize site


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