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Search term: OTSLYLLOBTYVLP-NRFANRHFSA-N (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 4-{1-[(5,7-Dimethyl-1H-indol-4-yl)methyl]-2-piperidinyl}benzoic acid | C23H26N2O2

4-{1-[(5,7-Dimethyl-1H-indol-4-yl)methyl]-2-piperidinyl}benzoic acid

  • Molecular FormulaC23H26N2O2
  • Average mass362.465 Da
  • Monoisotopic mass362.199432 Da
  • ChemSpider ID127441824

More details:

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

4-{1-[(5,7-Dimethyl-1H-indol-4-yl)methyl]-2-piperidinyl}benzoesäure [German] [ACD/IUPAC Name]
4-{1-[(5,7-Dimethyl-1H-indol-4-yl)methyl]-2-piperidinyl}benzoic acid [ACD/IUPAC Name]
Acide 4-{1-[(5,7-diméthyl-1H-indol-4-yl)méthyl]-2-pipéridinyl}benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[1-[(5,7-dimethyl-1H-indol-4-yl)methyl]-2-piperidinyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 561.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.9±3.0 kJ/mol
Flash Point: 293.5±30.1 °C
Index of Refraction: 1.654
Molar Refractivity: 109.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.71
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 14.37
ACD/KOC (pH 5.5): 45.36
ACD/LogD (pH 7.4): 2.63
ACD/BCF (pH 7.4): 14.63
ACD/KOC (pH 7.4): 46.18
Polar Surface Area: 56 Å2
Polarizability: 43.2±0.5 10-24cm3
Surface Tension: 56.6±3.0 dyne/cm
Molar Volume: 297.5±3.0 cm3

Click to predict properties on the Chemicalize site


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