ChemSpider 2D Image | 2-({1-Carboxylato-2-[1-(3,5-dichlorobenzyl)-1H-imidazol-5-yl]ethyl}amino)-4-methylpentanoate | C19H21Cl2N3O4

2-({1-Carboxylato-2-[1-(3,5-dichlorobenzyl)-1H-imidazol-5-yl]ethyl}amino)-4-methylpentanoate

  • Molecular FormulaC19H21Cl2N3O4
  • Average mass426.295 Da
  • Monoisotopic mass425.092010 Da
  • ChemSpider ID95720856

  • Charge - Charge

More details:

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

2-({1-Carboxylato-2-[1-(3,5-dichlorbenzyl)-1H-imidazol-5-yl]ethyl}amino)-4-methylpentanoat [German] [ACD/IUPAC Name]
2-({1-Carboxylato-2-[1-(3,5-dichlorobenzyl)-1H-imidazol-5-yl]ethyl}amino)-4-methylpentanoate [ACD/IUPAC Name]
2-({1-Carboxylato-2-[1-(3,5-dichlorobenzyl)-1H-imidazol-5-yl]éthyl}amino)-4-méthylpentanoate [French] [ACD/IUPAC Name]
Histidine, N-(1-carboxy-3-methylbutyl)-3-[(3,5-dichlorophenyl)methyl]-, ion(2-) [ACD/Index Name]

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

Density:
Boiling Point: 639.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.3±3.0 kJ/mol
Flash Point: 340.6±31.5 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.85
ACD/LogD (pH 5.5): 0.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.78
ACD/LogD (pH 7.4): -0.69
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 110 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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