Found 3 results

Search term: AJYIZQUARKFPEC (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (8aR)-6-Bromo-1-methyl-3a-(2-methyl-3-buten-2-yl)-8-(3-methyl-2-buten-1-yl)-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indole | C21H29BrN2

(8aR)-6-Bromo-1-methyl-3a-(2-methyl-3-buten-2-yl)-8-(3-methyl-2-buten-1-yl)-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indole

  • Molecular FormulaC21H29BrN2
  • Average mass389.372 Da
  • Monoisotopic mass388.151398 Da
  • ChemSpider ID58818108

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(8aR)-6-Brom-1-methyl-3a-(2-methyl-3-buten-2-yl)-8-(3-methyl-2-buten-1-yl)-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol [German] [ACD/IUPAC Name]
(8aR)-6-Bromo-1-methyl-3a-(2-methyl-3-buten-2-yl)-8-(3-methyl-2-buten-1-yl)-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indole [ACD/IUPAC Name]
(8aR)-6-Bromo-1-méthyl-3a-(2-méthyl-3-butén-2-yl)-8-(3-méthyl-2-butén-1-yl)-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indole [French] [ACD/IUPAC Name]
Pyrrolo[2,3-b]indole, 6-bromo-3a-(1,1-dimethyl-2-propen-1-yl)-1,2,3,3a,8,8a-hexahydro-1-methyl-8-(3-methyl-2-buten-1-yl)-, (8aR)- [ACD/Index Name]
(3AR,8AR)-6-BROMO-1-METHYL-8-(3-METHYLBUT-2-EN-1-YL)-3A-(2-METHYLBUT-3-EN-2-YL)-1H,2H,3H,3AH,8H,8AH-PYRROLO[2,3-B]INDOLE
(3AR,8AR)-6-BROMO-1-METHYL-8-(3-METHYLBUT-2-EN-1-YL)-3A-(2-METHYLBUT-3-EN-2-YL)-2H,3H,8AH-PYRROLO[2,3-B]INDOLE
71239-64-0 [RN]
flustramine A

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

Density: 1.2±0.1 g/cm3
Boiling Point: 438.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.5±3.0 kJ/mol
Flash Point: 218.9±28.7 °C
Index of Refraction: 1.569
Molar Refractivity: 106.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 6.29
ACD/LogD (pH 5.5): 3.23
ACD/BCF (pH 5.5): 43.42
ACD/KOC (pH 5.5): 104.04
ACD/LogD (pH 7.4): 4.94
ACD/BCF (pH 7.4): 2210.21
ACD/KOC (pH 7.4): 5296.29
Polar Surface Area: 6 Å2
Polarizability: 42.1±0.5 10-24cm3
Surface Tension: 39.2±3.0 dyne/cm
Molar Volume: 324.2±3.0 cm3

Click to predict properties on the Chemicalize site


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