Erythrosin-5-isothiocyanate

3',6'-dihydroxy-2',4',5',7'-tetraiodo-6-isothiocyanatospiro[2-benzofuran-3,9'-xanthene]-1-one

Also Known As: Erythrosin-5-isothiocyanate|Erythrosin isothiocyanate|Erythrosin 5-isothiocyanate|J1.498.516F|3',6'-dihydroxy-2',4',5',7'-tetraiodo-6-isothiocyanatospiro[2-benzofuran-3,9'-xanthene]-1-one|Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one,3',6'-dihydroxy-2',4',5',7'-tetraiodo-5-isothiocyanato-|3 ,6 -Dihydroxy-2 ,4 ,5 ,7 -tetraiodo-5-isothiocyanatospiro[isobenzofuran-1(3H),9 -[9H]xanthene]-3-one|3',6'-Dihydroxy-2',4',5',7'-tetraiodo-5-isothiocyanato-3H-spiro[[2]benzofuran-1,9'-xanthen]-3-one|3',6'-dihydroxy-2',4',5',7'-tetraiodo-5-isothiocyanato-3H-spiro[2-benzofuran-1,9'-xanthen]-3-one|3',6'-dihydroxy-2',4',5',7'-tetraiodo-6-isothiocyanato-spiro[isobenzofuran-3,9'-xanthene]-1-one|SPIRO(ISOBENZOFURAN-1(3H),9'-(9H) XANTHEN)-3-ONE, (3',6'-DIHYDROXY-2',4',5',7'-TETRAIODO- 5-ISOTHIOCYANATO)

Molecular Formula	C21H7I4NO5S
Molecular Weight	892.6224 g/mol
LogP	6.8185
Topological Polar Surface Area	88.35 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	1
Exact Mass	892.6224
Monoisotopic Mass	892.6224
Heavy Atoms	32
Complexity	1371.163

Chemical Identifiers

CAS Number	90284-47-2
SMILES	C1=CC2=C(C=C1N=C=S)C(=O)OC23C4=CC(=C(C(=C4OC5=C(C(=C(C=C35)I)O)I)I)O)I