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Search term: YVLFYHDKVVFNAP-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 4-[5,5,7,7,10,10-Hexamethyl-1-(3-pyridinylmethyl)-4,5,7,8,9,10-hexahydro-1H-naphtho[2,3-g]indol-3-yl]benzoic acid | C35H38N2O2

4-[5,5,7,7,10,10-Hexamethyl-1-(3-pyridinylmethyl)-4,5,7,8,9,10-hexahydro-1H-naphtho[2,3-g]indol-3-yl]benzoic acid

  • Molecular FormulaC35H38N2O2
  • Average mass518.688 Da
  • Monoisotopic mass518.293335 Da
  • ChemSpider ID8634695

More details:

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

4-[5,5,7,7,10,10-Hexamethyl-1-(3-pyridinylmethyl)-4,5,7,8,9,10-hexahydro-1H-naphtho[2,3-g]indol-3-yl]benzoesäure [German] [ACD/IUPAC Name]
4-[5,5,7,7,10,10-Hexamethyl-1-(3-pyridinylmethyl)-4,5,7,8,9,10-hexahydro-1H-naphtho[2,3-g]indol-3-yl]benzoic acid [ACD/IUPAC Name]
4-[5,5,7,7,10,10-hexamethyl-1-(pyridin-3-ylmethyl)-4,5,7,8,9,10-hexahydro-1H-naphtho[2,3-g]indol-3-yl]benzoic acid
Acide 4-[5,5,7,7,10,10-hexaméthyl-1-(3-pyridinylméthyl)-4,5,7,8,9,10-hexahydro-1H-naphto[2,3-g]indol-3-yl]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[4,5,7,8,9,10-hexahydro-5,5,7,7,10,10-hexamethyl-1-(3-pyridinylmethyl)-1H-naphth[2,3-g]indol-3-yl]- [ACD/Index Name]
4-(5,5,7,7,10,10-Hexamethyl-1-pyridin-3-ylmethyl-4,5,7,8,9,10-hexahydro-1H-naphtho[2,3-g]indol-3-yl)-benzoic acid

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

Density: 1.2±0.1 g/cm3
Boiling Point: 675.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.2±3.0 kJ/mol
Flash Point: 362.5±31.5 °C
Index of Refraction: 1.627
Molar Refractivity: 157.8±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 10.37
ACD/LogD (pH 5.5): 8.31
ACD/BCF (pH 5.5): 607096.19
ACD/KOC (pH 5.5): 209022.39
ACD/LogD (pH 7.4): 6.74
ACD/BCF (pH 7.4): 16367.63
ACD/KOC (pH 7.4): 5635.36
Polar Surface Area: 55 Å2
Polarizability: 62.5±0.5 10-24cm3
Surface Tension: 43.3±7.0 dyne/cm
Molar Volume: 445.1±7.0 cm3

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