Found 2 results

Search term: YVIYYIINOVTGCN (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (3aS,11bS)-2-Amino-11-bromo-5,6,9,11b-tetrahydro-4H-imidazo[4,5-h]pyrrolo[2,3-f]indolizin-8(1H)-one | C11H12BrN5O

(3aS,11bS)-2-Amino-11-bromo-5,6,9,11b-tetrahydro-4H-imidazo[4,5-h]pyrrolo[2,3-f]indolizin-8(1H)-one

  • Molecular FormulaC11H12BrN5O
  • Average mass310.150 Da
  • Monoisotopic mass309.022522 Da
  • ChemSpider ID28650551

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3aS,11bS)-2-Amino-11-brom-5,6,9,11b-tetrahydro-4H-imidazo[4,5-h]pyrrolo[2,3-f]indolizin-8(1H)-on [German] [ACD/IUPAC Name]
(3aS,11bS)-2-Amino-11-bromo-5,6,9,11b-tetrahydro-4H-imidazo[4,5-h]pyrrolo[2,3-f]indolizin-8(1H)-one [ACD/IUPAC Name]
(3aS,11bS)-2-Amino-11-bromo-5,6,9,11b-tétrahydro-4H-imidazo[4,5-h]pyrrolo[2,3-f]indolizin-8(1H)-one [French] [ACD/IUPAC Name]
4H-Imidazo[4,5-h]pyrrolo[2,3-f]indolizin-8(1H)-one, 2-amino-11-bromo-5,6,9,11b-tetrahydro-, (3aS,11bS)- [ACD/Index Name]

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

Density: 2.3±0.1 g/cm3
Boiling Point: 576.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.4±3.0 kJ/mol
Flash Point: 302.7±32.9 °C
Index of Refraction: 2.016
Molar Refractivity: 67.0±0.5 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -1.64
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 87 Å2
Polarizability: 26.6±0.5 10-24cm3
Surface Tension: 105.1±7.0 dyne/cm
Molar Volume: 132.6±7.0 cm3

Click to predict properties on the Chemicalize site


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