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1,1'-[(Bromomethanediyl)disulfonyl]dibenzene

HCID 279786
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Basic information

CAS
18087-04-2
Standard SMILES
O=S(=O)(c1ccccc1)C(Br)S(=O)(=O)c1ccccc1
InChIKey
JQZULCGDVVRTEA-UHFFFAOYSA-N
Molecular formula
C13H11BrO4S2
Average molar mass
375.3 g/mol
Monoisotopic mass
373.92821

Names & identifiers

Preferred name
1,1'-[(Bromomethanediyl)disulfonyl]dibenzene
IUPAC
[benzenesulfonyl(bromo)methyl]sulfonylbenzene

Names & synonyms

MLS00292008218087-04-21,1'-[(bromomethanediyl)disulfonyl]dibenzeneNSC131068CHEMBL2135103DTXSID40299496NSC-131068SMR0017976791,1'-[(Bromomethylene)disulfonyl]dibenzene

Database identifiers

CAS
18087-04-2
PubChem CID
279786
DTXSID
DTXSID40299496
ChEMBL
CHEMBL2135103

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
85 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
20
Formal charge
0
Complexity
456

Related reactions

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Compound notes

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