ChemSpider 2D Image | 2-[(9H-beta-Carbolin-3-ylcarbonyl)amino]ethanesulfonic acid | C14H13N3O4S

2-[(9H-β-Carbolin-3-ylcarbonyl)amino]ethanesulfonic acid

  • Molecular FormulaC14H13N3O4S
  • Average mass319.336 Da
  • Monoisotopic mass319.062683 Da
  • ChemSpider ID35517147

More details:

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

2-[(9H-β-Carbolin-3-ylcarbonyl)amino]ethanesulfonic acid [ACD/IUPAC Name]
2-[(9H-β-Carbolin-3-ylcarbonyl)amino]ethansulfonsäure [German] [ACD/IUPAC Name]
Acide 2-[(9H-β-carbolin-3-ylcarbonyl)amino]éthanesulfonique [French] [ACD/IUPAC Name]
Ethanesulfonic acid, 2-[(9H-pyrido[3,4-b]indol-3-ylcarbonyl)amino]- [ACD/Index 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.729
Molar Refractivity: 81.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.05
ACD/LogD (pH 5.5): -3.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.75
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 121 Å2
Polarizability: 32.3±0.5 10-24cm3
Surface Tension: 85.2±3.0 dyne/cm
Molar Volume: 204.6±3.0 cm3

Click to predict properties on the Chemicalize site


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