Molecular Identity
Rose Bengal Sodium
disodium;2,3,4,5-tetrachloro-6-(2,4,5,7-tetraiodo-3-oxido-6-oxoxanthen-9-yl)benzoate
PubChem CID: 32343
2D Structure
Properties
C20H2Cl4I4Na2O5
Molecular Formula
1017.60
Molecular Weight
g/mol
1017.4601
Exact Mass
Da
89.5
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
5
H-Bond Acceptors
936
Complexity
SMILES
Canonical SMILES
SMILES: C1=C2C(=C3C=C(C(=O)C(=C3OC2=C(C(=C1I)[O-])I)I)I)C4=C(C(=C(C(=C4Cl)Cl)Cl)Cl)C(=O)[O-].[Na+].[Na+]Isomeric SMILES
SMILES: C1=C2C(=C3C=C(C(=O)C(=C3OC2=C(C(=C1I)[O-])I)I)I)C4=C(C(=C(C(=C4Cl)Cl)Cl)Cl)C(=O)[O-].[Na+].[Na+]Synonyms(20)
Rose bengal sodiumRose bengal extraRose Bengal disodiumBengal Rose B sodium saltJapan red 105-1Red no. 105-1Aka105(1)DTXSID4022814DTXCID702814956575SN5LSODIUM TETRAIODOTETRACHLOROFLUORESCEINROSE BENGAL SODIUM (MART.)ROSE BENGAL SODIUM [MART.]2',4',5',7'-TETRAIODO-3,4,5,6-TETRACHLOROFLUORESCEIN DISODIUM SALT3',4',5',6'-TETRACHLORO-2,4,5,7-TETRAIODOFLUORESCEIN DISODIUM SALT
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Rose Bengal Sodium
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