ChemSpider 2D Image | Erythrosine | C20H8I4O5

Erythrosine

  • Molecular FormulaC20H8I4O5
  • Average mass835.892 Da
  • Monoisotopic mass835.655029 Da
  • ChemSpider ID3144

More details:






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

15905-32-5 [RN]
240-046-0 [EINECS]
3',6'-Dihydroxy-2',4',5',7'-tetraiod-3H-spiro[2-benzofuran-1,9'-xanthen]-3-on [German] [ACD/IUPAC Name]
3',6'-Dihydroxy-2',4',5',7'-tetraiodo-3H-spiro[2-benzofuran-1,9'-xanthen]-3-one [ACD/IUPAC Name]
3',6'-Dihydroxy-2',4',5',7'-tétraiodo-3H-spiro[2-benzofuran-1,9'-xanthen]-3-one [French] [ACD/IUPAC Name]
Erythrosine [Wiki]
Erythrosine Phenolic
Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 3',6'-dihydroxy-2',4',5',7'-tetraiodo- [ACD/Index Name]
12,15-dihydroxy-11,13,14,16-tetraiodospiro[3-hydroisobenzofuran-3,9'-xanthene] -1-one
12,15-dihydroxy-11,13,14,16-tetraiodospiro[3-hydroisobenzofuran-3,9'-xanthene]-1-one
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

200964_ALDRICH [DBID]
206806_ALDRICH [DBID]
BRN 0062817 [DBID]
C.I. 45430 [DBID]
CCRIS 4901 [DBID]
NSC 328781 [DBID]
NSC328781 [DBID]
ZINC05224800 [DBID]

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

Density: 2.9±0.1 g/cm3
Boiling Point: 628.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.4±3.0 kJ/mol
Flash Point: 333.8±31.5 °C
Index of Refraction: 1.972
Molar Refractivity: 139.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 2
ACD/LogP: 7.14
ACD/LogD (pH 5.5): 7.15
ACD/BCF (pH 5.5): 160020.27
ACD/KOC (pH 5.5): 183795.02
ACD/LogD (pH 7.4): 6.70
ACD/BCF (pH 7.4): 55910.98
ACD/KOC (pH 7.4): 64217.86
Polar Surface Area: 76 Å2
Polarizability: 55.4±0.5 10-24cm3
Surface Tension: 116.5±5.0 dyne/cm
Molar Volume: 284.7±5.0 cm3

Click to predict properties on the Chemicalize site





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