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2,2-Diiodo-1,1-ethanedisulfonic acid

HCID 407660
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Basic information

CAS
6291-64-1
Standard SMILES
O=S(=O)(O)C(C(I)I)S(=O)(=O)O
InChIKey
YCMQLVCDXBHSJJ-UHFFFAOYSA-N
Molecular formula
C2H4I2O6S2
Average molar mass
441.99 g/mol
Monoisotopic mass
441.75388

Names & identifiers

Preferred name
2,2-Diiodo-1,1-ethanedisulfonic acid
IUPAC
2,2-diiodoethane-1,1-disulfonic acid

Names & synonyms

2,2-Diiodo-1,1-ethanedisulfonic acid6291-64-12,2-diiodoethane-1,1-disulfonic acidNSC 8540NSC8540DTXSID90212099

Database identifiers

CAS
6291-64-1
PubChem CID
407660
DTXSID
DTXSID90212099

Properties

Computed structural properties

XLogP
-0.1
Topological polar surface area
126 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
12
Formal charge
0
Complexity
297

Related reactions

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Compound notes

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