Found 6 results

Search term: QSHWIQZFGQKFMA (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 3-[5-(Aminomethyl)-4-(carboxymethyl)-1H-pyrrol-3-yl](1,2-~13~C_2_)propanoic acid | C813C2H14N2O4

3-[5-(Aminomethyl)-4-(carboxymethyl)-1H-pyrrol-3-yl](1,2-13C2)propanoic acid

  • Molecular FormulaC813C2H14N2O4
  • Average mass228.214 Da
  • Monoisotopic mass228.102066 Da
  • ChemSpider ID98644542

  • Non-standard isotope - Non-standard isotope

More details:

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

1H-Pyrrole-3-propanoic-α,carboxy-13C2 acid, 5-(aminomethyl)-4-(carboxymethyl)- [ACD/Index Name]
3-[5-(Aminomethyl)-4-(carboxymethyl)-1H-pyrrol-3-yl](1,2-13C2)propanoic acid [ACD/IUPAC Name]
3-[5-(Aminomethyl)-4-(carboxymethyl)-1H-pyrrol-3-yl](1,2-13C2)propansäure [German] [ACD/IUPAC Name]
Acide 3-[5-(aminométhyl)-4-(carboxyméthyl)-1H-pyrrol-3-yl](1,2-13C2)propanoïque [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.621
Molar Refractivity: 56.0±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 75.6±3.0 dyne/cm
Molar Volume: 159.1±3.0 cm3

Click to predict properties on the Chemicalize site


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