Found 138 results

Search term: MF = 'C_{8}H_{11}N_{3}O_{6}S'
ChemSpider 2D Image | N-{[4-(Ethoxycarbonyl)-1H-pyrazol-5-yl]sulfonyl}glycine | C8H11N3O6S

N-{[4-(Ethoxycarbonyl)-1H-pyrazol-5-yl]sulfonyl}glycine

  • Molecular FormulaC8H11N3O6S
  • Average mass277.254 Da
  • Monoisotopic mass277.036865 Da
  • ChemSpider ID57768842

More details:

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

1H-Pyrazole-4-carboxylic acid, 5-[[(carboxymethyl)amino]sulfonyl]-, 4-ethyl ester [ACD/Index Name]
N-{[4-(Ethoxycarbonyl)-1H-pyrazol-5-yl]sulfonyl}glycin [German] [ACD/IUPAC Name]
N-{[4-(Ethoxycarbonyl)-1H-pyrazol-5-yl]sulfonyl}glycine [ACD/IUPAC Name]
N-{[4-(Éthoxycarbonyl)-1H-pyrazol-5-yl]sulfonyl}glycine [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 599.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.9±3.0 kJ/mol
Flash Point: 316.5±32.9 °C
Index of Refraction: 1.564
Molar Refractivity: 57.6±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -0.56
ACD/LogD (pH 5.5): -2.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 147 Å2
Polarizability: 22.8±0.5 10-24cm3
Surface Tension: 71.3±3.0 dyne/cm
Molar Volume: 177.1±3.0 cm3

Click to predict properties on the Chemicalize site


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