ChemSpider 2D Image | Methyl 2-chloro-5-{[(2-oxo-1-oxa-3,8-diazaspiro[4.5]dec-8-yl)carbonyl]amino}benzoate | C16H18ClN3O5

Methyl 2-chloro-5-{[(2-oxo-1-oxa-3,8-diazaspiro[4.5]dec-8-yl)carbonyl]amino}benzoate

  • Molecular FormulaC16H18ClN3O5
  • Average mass367.784 Da
  • Monoisotopic mass367.093506 Da
  • ChemSpider ID30925640

More details:

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

2-Chloro-5-{[(2-oxo-1-oxa-3,8-diazaspiro[4.5]déc-8-yl)carbonyl]amino}benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-chloro-5-[[(2-oxo-1-oxa-3,8-diazaspiro[4.5]dec-8-yl)carbonyl]amino]-, methyl ester [ACD/Index Name]
Methyl 2-chloro-5-{[(2-oxo-1-oxa-3,8-diazaspiro[4.5]dec-8-yl)carbonyl]amino}benzoate [ACD/IUPAC Name]
Methyl-2-chlor-5-{[(2-oxo-1-oxa-3,8-diazaspiro[4.5]dec-8-yl)carbonyl]amino}benzoat [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 686.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.7±3.0 kJ/mol
Flash Point: 369.2±31.5 °C
Index of Refraction: 1.622
Molar Refractivity: 88.8±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.13
ACD/LogD (pH 5.5): 2.41
ACD/BCF (pH 5.5): 39.93
ACD/KOC (pH 5.5): 487.35
ACD/LogD (pH 7.4): 2.41
ACD/BCF (pH 7.4): 39.93
ACD/KOC (pH 7.4): 487.29
Polar Surface Area: 97 Å2
Polarizability: 35.2±0.5 10-24cm3
Surface Tension: 64.9±5.0 dyne/cm
Molar Volume: 252.2±5.0 cm3

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