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Search term: HSTCMJJFYYQQRG (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-[(2-{2-[1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetoxy}benzoyl)oxy]benzoic acid | C33H24ClNO8

2-[(2-{2-[1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetoxy}benzoyl)oxy]benzoic acid

  • Molecular FormulaC33H24ClNO8
  • Average mass597.999 Da
  • Monoisotopic mass597.119019 Da
  • ChemSpider ID50176

More details:

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

1H-Indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-, 2-[(2-carboxyphenoxy)carbonyl]phenyl ester [ACD/Index Name]
2-[(2-{2-[1-(4-Chlorbenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetoxy}benzoyl)oxy]benzoesäure [German] [ACD/IUPAC Name]
2-[(2-{2-[1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetoxy}benzoyl)oxy]benzoic acid [ACD/IUPAC Name]
Acide 2-[(2-{2-[1-(4-chlorobenzoyl)-5-méthoxy-2-méthyl-1H-indol-3-yl]acétoxy}benzoyl)oxy]benzoïque [French] [ACD/IUPAC Name]
1H-INDOLE-3-ACETIC ACID, 1-(4-CHLOROBENZOYL)-5-METHOXY-2-METHYL-2-((2-CARBOXYPHE
2-((2-carboxyphenoxy)carbonyl)phenyl-1-(4-chlorobenzoyl)-5-methoxy-2-methylindole-3-acetate
86811-46-3 [RN]

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

TB 220 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 763.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 116.7±3.0 kJ/mol
Flash Point: 415.7±32.9 °C
Index of Refraction: 1.632
Molar Refractivity: 158.5±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.71
ACD/LogD (pH 5.5): 3.88
ACD/BCF (pH 5.5): 134.22
ACD/KOC (pH 5.5): 231.68
ACD/LogD (pH 7.4): 3.21
ACD/BCF (pH 7.4): 28.90
ACD/KOC (pH 7.4): 49.88
Polar Surface Area: 121 Å2
Polarizability: 62.8±0.5 10-24cm3
Surface Tension: 51.1±7.0 dyne/cm
Molar Volume: 444.5±7.0 cm3

Click to predict properties on the Chemicalize site


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