Found 8 results

Search term: NFIVJOSXJDORSP (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1-Carboxy-2-[4-(dihydroxyboryl)phenyl]ethanaminium | C9H13BNO4

1-Carboxy-2-[4-(dihydroxyboryl)phenyl]ethanaminium

  • Molecular FormulaC9H13BNO4
  • Average mass210.014 Da
  • Monoisotopic mass210.093216 Da
  • ChemSpider ID77420308

  • Charge - Charge

More details:

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

1-Carboxy-2-[4-(dihydroxyboryl)phenyl]ethanaminium [German] [ACD/IUPAC Name]
1-Carboxy-2-[4-(dihydroxyboryl)phenyl]ethanaminium [ACD/IUPAC Name]
1-Carboxy-2-[4-(dihydroxyboryl)phényl]éthanaminium [French] [ACD/IUPAC Name]
Phenylalanine, 4-borono-, conjugate acid [ACD/Index Name]

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

Density:
Boiling Point: 449.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.6±3.0 kJ/mol
Flash Point: 225.5±31.5 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 0.49
ACD/LogD (pH 5.5): -2.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 105 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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