ChemSpider 2D Image | (7,7-Dioxido-2-oxo-1-oxa-7-thia-3-azaspiro[4.4]non-3-yl)acetic acid | C8H11NO6S

(7,7-Dioxido-2-oxo-1-oxa-7-thia-3-azaspiro[4.4]non-3-yl)acetic acid

  • Molecular FormulaC8H11NO6S
  • Average mass249.241 Da
  • Monoisotopic mass249.030701 Da
  • ChemSpider ID49634769

More details:






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

(7,7-Dioxido-2-oxo-1-oxa-7-thia-3-azaspiro[4.4]non-3-yl)acetic acid [ACD/IUPAC Name]
(7,7-Dioxido-2-oxo-1-oxa-7-thia-3-azaspiro[4.4]non-3-yl)essigsäure [German] [ACD/IUPAC Name]
1-Oxa-7-thia-3-azaspiro[4.4]nonane-3-acetic acid, 2-oxo-, 7,7-dioxide [ACD/Index Name]
Acide (2-oxo-7,7-dioxydo-1-oxa-7-thia-3-azaspiro[4.4]non-3-yl)acétique [French] [ACD/IUPAC Name]
1781387-78-7 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 710.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.9 mmHg at 25°C
Enthalpy of Vaporization: 113.2±6.0 kJ/mol
Flash Point: 383.5±31.5 °C
Index of Refraction: 1.606
Molar Refractivity: 51.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.08
ACD/LogD (pH 5.5): -2.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 109 Å2
Polarizability: 20.3±0.5 10-24cm3
Surface Tension: 78.2±5.0 dyne/cm
Molar Volume: 148.4±5.0 cm3

Click to predict properties on the Chemicalize site






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