ChemSpider 2D Image | 2',4',5',7'-Tetrabromo-5-(chloromethyl)-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthene]-3',6'-diyl diacetate | C25H13Br4ClO7

2',4',5',7'-Tetrabromo-5-(chloromethyl)-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthene]-3',6'-diyl diacetate

  • Molecular FormulaC25H13Br4ClO7
  • Average mass780.435 Da
  • Monoisotopic mass775.708313 Da
  • ChemSpider ID170527

More details:






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

2',4',5',7'-Tetrabrom-5-(chlormethyl)-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthene]-3',6'-diyl-diacetat [German] [ACD/IUPAC Name]
2',4',5',7'-Tetrabromo-5-(chloromethyl)-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthene]-3',6'-diyl diacetate [ACD/IUPAC Name]
Diacétate de 2',4',5',7'-tétrabromo-5-(chlorométhyl)-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthene]-3',6'-diyle [French] [ACD/IUPAC Name]
Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 3',6'-bis(acetyloxy)-2',4',5',7'-tetrabromo-5-(chloromethyl)- [ACD/Index Name]
136832-64-9 [RN]
3'-(ACETYLOXY)-2',4',5',7'-TETRABROMO-5-(CHLOROMETHYL)-3-OXO-3H-SPIRO[2-BENZOFURAN-1,9'-XANTHENE]-6'-YL ACETATE
3'-(ACETYLOXY)-2',4',5',7'-TETRABROMO-5-(CHLOROMETHYL)-3-OXOSPIRO[2-BENZOFURAN-1,9'-XANTHENE]-6'-YL ACETATE
5-Chloromethyleosin
5-Chloromethyleosin diacetate
CMEDA
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.2±0.1 g/cm3
Boiling Point: 784.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.1±3.0 kJ/mol
Flash Point: 428.2±32.9 °C
Index of Refraction: 1.754
Molar Refractivity: 147.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 5.71
ACD/LogD (pH 5.5): 7.10
ACD/BCF (pH 5.5): 146081.31
ACD/KOC (pH 5.5): 173138.55
ACD/LogD (pH 7.4): 7.10
ACD/BCF (pH 7.4): 146081.31
ACD/KOC (pH 7.4): 173138.55
Polar Surface Area: 88 Å2
Polarizability: 58.5±0.5 10-24cm3
Surface Tension: 86.0±5.0 dyne/cm
Molar Volume: 360.7±5.0 cm3

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