Tetrahydroxyquinone disodium
Basic information
- CAS
1887-02-1- Standard SMILES
O=C1C([O-])=C(O)C(=O)C(O)=C1[O-].[Na+].[Na+]- InChIKey
SOSMJTGSYNGZAV-UHFFFAOYSA-L- Molecular formula
- C6H2Na2O6
- Average molar mass
- 216.06 g/mol
- Monoisotopic mass
- 215.96467634
Overview
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Names & identifiers
- Preferred name
- Tetrahydroxyquinone disodium
- IUPAC
- disodium;4,6-dihydroxy-2,5-dioxocyclohexa-3,6-diene-1,3-diolate
- English name
- Tetrahydroxy-1,4-benzoquinone disodium salt
- Molecular formula
- C6H5NaO6
- Molecular weight
- 196.09
Names & synonyms
Tetrahydroxyquinone disodiumTetroquinone disodium derivativeTetrahydroxyquinone, disodium saltNCI 974EINECS 217-557-2NSC 33520Tetrahydroxyquinone disodium derivativeM 122p-Benzoquinone, tetrahydroxy-, disodium deriv.RefChem:897200Tetrahydroxypbenzoquinone disodium saltpBenzoquinone, tetrahydroxy, disodium deriv.
Show more names
JACS-1887-02-1Tetroquinone disodium saltDISODIUM SALT TETRAHYDROXYQUINONETETRAHYDROXY-1,4-BENZOQUINONE DISODIUMTETRAHYDROXY-P-BENZOQUINONE DISODIUM SALT
2,3,5,6Tetrahydroxy1,4benzoquinone, disodium saltpBenzoquinone, 2,3,5,6tetrahydroxy, disodium saltpBenzoquinone, 2,3,5,6tetrahydroxy, disodium salt (8CI)2,5Cyclohexadiene1,4dione, 2,3,5,6tetrahydroxy, disodium salt2,5Cyclohexadiene1,4dione, 2,3,5,6tetrahydroxy, sodium salt (1:2)Tetrahydroxyquinone disodium salt1887-02-1Sodium 4,5-Dihydroxy-3,6-dioxocyclohexa-1,4-diene-1,2-bis(olate)
Database identifiers
- CAS
1887-02-1- PubChem CID
- 74675
- DTXSID
DTXSID7062037- UNII
- IOZ23KE65J
- EC Number
- 217-557-2
- Nikkaji
- J261.092B
Properties
Computed structural properties
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 304
Experimental & physicochemical properties
Chemical ClassesOther Classes -> Aromatic Ketones
Physical DescriptionDark green lustrous crystals; [BDH Laboratory Supplies MSDS]
Physicochemical properties
- storage temp.
- Inert atmosphere,Room Temperature
- form
- powder to crystal
- color
- Green to Dark green to Dark blue
- Merck
- 14 · 14,9249
- CAS DataBase Reference
- 1887 · 1887-02-1(CAS DataBase Reference)
- FDA UNII
- 23 KE65J · IOZ23KE65J
- EPA Substance Registry System
- 2 · 2,5-Cyclohexadiene-1,4-dione, 2,3,5,6-tetrahydroxy-, disodium salt (1887-02-1)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
- TSCA
- TSCA listed
- HS Code
- 2914.69 · 2914.69.9000
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Hazards SummaryMay cause skin and eye irritation; [BDH Laboratory Supplies MSDS] See Quinone.
Safety data
- tsca
- TSCA listed
- hs_code
- 2914.69.9000
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 26-36/37/39
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Applications
UsesTETRAHYDROXY-1,4-BENZOQUINONE DISODIUM SALT is used as organic synthesis intermediate and pharmaceutical intermediate, mainly used in laboratory research and development process and chemical production process.
Suppliers
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Compound notes
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