ChemSpider 2D Image | tert-Butyl 4-(1-(4-methylbenzyl)-1H-benzo[d]imidazol-2-yl)piperidine-1-carboxylate | C25H31N3O2

tert-Butyl 4-(1-(4-methylbenzyl)-1H-benzo[d]imidazol-2-yl)piperidine-1-carboxylate

  • Molecular FormulaC25H31N3O2
  • Average mass405.533 Da
  • Monoisotopic mass405.241638 Da
  • ChemSpider ID28539453

More details:

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

1420894-06-9 [RN]
1-Piperidinecarboxylic acid, 4-[1-[(4-methylphenyl)methyl]-1H-benzimidazol-2-yl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-[1-(4-methylbenzyl)-1H-benzimidazol-2-yl]-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-[1-(4-methylbenzyl)-1H-benzimidazol-2-yl]-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-[1-(4-Méthylbenzyl)-1H-benzimidazol-2-yl]-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-Butyl 4-(1-(4-methylbenzyl)-1H-benzo[d]imidazol-2-yl)piperidine-1-carboxylate
4-[1-(4-methylbenzyl)-1H-benzoimidazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester
4-[1-(4-methyl-benzyl)-1H-benzoimidazol-2-yl]-piperidine-1-carboxylic acid tert-butyl ester
4-[1-(4-methylphenyl)-1H-benzoimidazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester
MFCD24369853 [MDL number]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 582.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.1±3.0 kJ/mol
Flash Point: 305.9±30.1 °C
Index of Refraction: 1.599
Molar Refractivity: 120.6±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.55
ACD/LogD (pH 5.5): 5.14
ACD/BCF (pH 5.5): 4211.96
ACD/KOC (pH 5.5): 11747.10
ACD/LogD (pH 7.4): 5.37
ACD/BCF (pH 7.4): 7129.92
ACD/KOC (pH 7.4): 19885.27
Polar Surface Area: 47 Å2
Polarizability: 47.8±0.5 10-24cm3
Surface Tension: 42.0±7.0 dyne/cm
Molar Volume: 352.7±7.0 cm3

Click to predict properties on the Chemicalize site


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