ChemSpider 2D Image | [(7E)-7-(4-Ethoxybenzylidene)-3-(4-ethoxyphenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](4-methoxyphenyl)methanone | C32H34N2O4

[(7E)-7-(4-Ethoxybenzylidene)-3-(4-ethoxyphenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](4-methoxyphenyl)methanone

  • Molecular FormulaC32H34N2O4
  • Average mass510.623 Da
  • Monoisotopic mass510.251862 Da
  • ChemSpider ID4761162
  • Double-bond stereo - Double-bond stereo


More details:






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

[(7E)-7-(4-Ethoxybenzyliden)-3-(4-ethoxyphenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](4-methoxyphenyl)methanon [German] [ACD/IUPAC Name]
[(7E)-7-(4-Ethoxybenzylidene)-3-(4-ethoxyphenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](4-methoxyphenyl)methanone [ACD/IUPAC Name]
[(7E)-7-(4-Éthoxybenzylidène)-3-(4-éthoxyphényl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](4-méthoxyphényl)méthanone [French] [ACD/IUPAC Name]
Methanone, [(7E)-3-(4-ethoxyphenyl)-7-[(4-ethoxyphenyl)methylene]-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](4-methoxyphenyl)- [ACD/Index Name]
[(7E)-3-(4-ethoxyphenyl)-7-[(4-ethoxyphenyl)methylidene]-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-(4-methoxyphenyl)methanone
303227-75-0 [RN]
7-(4-ethoxybenzylidene)-3-(4-ethoxyphenyl)-2-(4-methoxybenzoyl)-3,3a,4,5,6,7-hexahydro-2H-indazole
YTCVSLAOWAOHKZ-NJNXFGOHSA-N

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

AN-512/12673182 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 682.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.2±3.0 kJ/mol
Flash Point: 366.8±34.3 °C
Index of Refraction: 1.601
Molar Refractivity: 148.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.55
ACD/LogD (pH 5.5): 6.00
ACD/BCF (pH 5.5): 21483.91
ACD/KOC (pH 5.5): 43886.76
ACD/LogD (pH 7.4): 6.00
ACD/BCF (pH 7.4): 21514.71
ACD/KOC (pH 7.4): 43949.69
Polar Surface Area: 60 Å2
Polarizability: 59.0±0.5 10-24cm3
Surface Tension: 42.8±7.0 dyne/cm
Molar Volume: 434.1±7.0 cm3

Click to predict properties on the Chemicalize site






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