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Bathophenanthroline disulfonic acid

HCID 65368
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Basic information

CAS
28061-20-3
Standard SMILES
O=S(=O)(Oc1ccccc1)c1ccnc2c1ccc1c(S(=O)(=O)Oc3ccccc3)ccnc12
InChIKey
STWJKLMRMTWJEY-UHFFFAOYSA-N
Molecular formula
C24H16N2O6S2
Average molar mass
492.5 g/mol
Monoisotopic mass
492.04497858

Names & identifiers

Preferred name
Bathophenanthroline disulfonic acid
IUPAC
diphenyl 1,10-phenanthroline-4,7-disulfonate
English name
bathophenanthroline disulfonic acid
Molecular weight
0

Names & synonyms

Bathophenanthroline disulfonic acid28061-20-3DTXSID50182345RefChem:116657DTXCID601048364,7-Phenylsulfonyl-1,10-phenanthrolinediphenyl 1,10-phenanthroline-4,7-disulfonateBathophenanthrolin-bisulfonsaure [German]Bathophenanthrolin-bisulfonsaure4,7-Diphenyl-1,10-phenanthrolinedisulfonic acid1,10-Phenanthrolinedisulfonic acid, 4,7-diphenyl-SCHEMBL19436389
Show more names
diphenyl-1,10-phenanthroline-4,7-disulfonate

Database identifiers

CAS
28061-20-3
PubChem CID
65368
DTXSID
DTXSID50182345

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
129 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
6
Heavy atoms
34
Formal charge
0
Complexity
813

Chemistry & industry

Pharmacology

MeSH Pharmacological Classification · 2 items

Chemicals that bind to and remove ions from solutions. Many chelating agents function through the formation of COORDINATION COMPLEXES with METALS.

Colorless, endogenous or exogenous pigment precursors that may be transformed by biological mechanisms into colored compounds; used in biochemical assays and in diagnosis as indicators, especially in the form of enzyme substrates. Synonym: chromogens (not to be confused with pigment-synthesizing bacteria also called chromogens).

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Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes