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Reference substances

Currently viewing:
IUPAC name:
disodium 1H,1'H-[2,2'-biindole]-3,3'-bis(olate)

Inventory

EC number:
212-974-6
EC name:
Disodium [2,2'-bi-1H-indole]-3,3'-diolate
CAS number:
894-86-0
CAS number:
894-86-0
Synonyms
Names:
[2,2'-Bi-1H-indole]-3,3'-diol, disodium salt
Identifier:
IUPAC name
disodium 2,2'-biindole-3,3'-diolate
Identifier:
other: Molecular formula
C16H12N2O2.2Na
Identifier:
other: InChl
InChI=1/C16H10N2O2.2Na/c19-15-9-5-1-3-7-11(9)17-13(15)14-16(20)10-6-2-4-8-12(10)18-14;;/h1-8,19-20H;;/q;2*+1/p-2
Identifier:
other: InChl
InChI=1S/C16H12N2O2.2Na/c19-15-9-5-1-3-7-11(9)17-13(15)14-16(20)10-6-2-4-8-12(10)18-14;;/h1-8,17-20H;;/q;2*+1/p-2
Identifier:
other: SMILES notation
[Na+].[Na+].[O-]C1=C(NC2=CC=CC=C12)C1=C([O-])C2=C(N1)C=CC=C2
Identifier:
other: SMILES notation
[Na+].[Na+].[O-]C1=C2C=CC=CC2=NC1=C3N=C4C=CC=CC4=C3[O-]
disodium 2-(3-oxido-1H-indol-2-yl)-1H-indol-3-olate

Molecular and structural information

Molecular formula:
C16H12N2O2.2Na
C16H10N2Na2O2
Molecular weight:
ca. 308
SMILES notation:
C1=CC=C4C(=C1)C(=C(C3=C(C2=CC=CC=C2[N]3)[O-])[N]4)[O-].[Na+].[Na+]
C12=CC=CC=C1C(=C([N]2)C4=C(C3=C(C=CC=C3)[N]4)[O-])[O-].[Na+].[Na+]
InChl:
InChI=1S/C16H12N2O2.2Na/c19-15-9-5-1-3-7-11(9)17-13(15)14-16(20)10-6-2-4-8-12(10)18-14;;/h1-8,17-20H;;/q;2*+1/p-2
InChI=1S/C16H12N2O2.2Na/c19-15-9-5-1-3-7-11(9)17-13(15)14-16(20)10-6-2-4-8-12(10)18-14;;/h1-8,17-20H;;/q;2*+1/p-2
Structural formula:
Chemical structure

Related substances

Identifier:
CAS number
Identity:
482-89-3