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Reference substances

Reference substances

IUPAC name:
disodium 9,10-dihydro-9,10-dioxoanthracene-2,7-disulphonate

Inventory

EC number:
212-718-3
EC name:
Disodium 9,10-dihydro-9,10-dioxoanthracene-2,7-disulphonate
CAS number:
853-67-8
CAS number:
853-67-8
Synonyms
Names:
2,7-Anthracenedisulfonic acid, 9,10-dihydro-9,10-dioxo-, disodium salt
Identifier:
IUPAC name
disodium; 9,10-dioxoanthracene-2,7-disulfonate
Identifier:
other: Molecular formula
C14H6Na2O8S2
Identifier:
other: SMILES notation
C1=CC2=C(C=C1S(=O)(=O)[O-])C(=O)C3=C(C2=O)C=CC(=C3)S(=O)(=O)[O-].[Na+].[Na+]
Identifier:
other: InChl
InChI=1S/C14H8O8S2.2Na/c15-13-9-3-1-7(23(17,18)19)5-11(9)14(16)12-6-8(24(20,21)22)2-4-10(12)13;;/h1-6H,(H,17,18,19)(H,20,21,22);;/q;2*+1/p-2
disodium 9,10-dioxo-9,10-dihydroanthracene-2,7-disulfonate

Molecular and structural information

Molecular formula:
C14H8O8S2.2Na
Molecular weight:
412.302
SMILES notation:
[Na+].[Na+].[O-]S(=O)(=O)c1ccc2C(=O)c3ccc(cc3C(=O)c2c1)S(=O)(=O)[O-]
InChl:
InChI=1/C14H8O8S2.2Na/c15-13-9-3-1-7(23(17,18)19)5-11(9)14(16)12-6-8(24(20,21)22)2-4-10(12)13;;/h1-6H,(H,17,18,19)(H,20,21,22);;/q;2*+1/p-2
Structural formula:
Chemical structure

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