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Tetrahydroxyquinone disodium

CAT: 0013-GTR19224648-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19224648-01Size:100 mg
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Description
Tetrahydroxyquinone disodium salt is a bioactive small molecule utilized in biochemical research. It serves as a key intermediate in studies of quinone chemistry and has been employed in in vitro assays to investigate redox processes and related biological mechanisms.
CAS Number
1887-02-1
Smiles
[NaH].[NaH].OC1=C (O) C (=O) C (O) =C (O) C1=O
Molecular Formula
C6H2Na2O6
Molecular Weight
216.06
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Tetrahydroxyquinone disodium

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CAS Number1887-02-1
PubChem CID74675
IUPAC Namedisodium;4,6-dihydroxy-2,5-dioxocyclohexa-3,6-diene-1,3-diolate
Molecular FormulaC6H2Na2O6
Molecular Weight216.06
Topological Polar Surface Area121
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Heavy Atom Count14
Formal Charge0
Complexity304
SMILES
C1(=C(C(=O)C(=C(C1=O)O)[O-])[O-])O.[Na+].[Na+]
InChI
InChI=1S/C6H4O6.2Na/c7-1-2(8)4(10)6(12)5(11)3(1)9;;/h7-8,11-12H;;/q;2*+1/p-2
InChIKey
SOSMJTGSYNGZAV-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of Tetrahydroxyquinone disodium
CAS: 1887-02-1
CID: 74675
Formula: C6H2Na2O6
MW: 216.06
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight216.06
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Exact Mass215.96467634
Monoisotopic Mass215.96467634
Topological Polar Surface Area121 Ų
Heavy Atom Count14
Formal Charge0
Complexity304
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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