Basic information
- CAS
850311-93-2- Standard SMILES
[Br-].[Mg+2].[c-]1ccc(SC2CCCCO2)cc1- InChIKey
HBAYXNBTUCEUJG-UHFFFAOYSA-M- Molecular formula
- C11H13BrMgOS
- Average molar mass
- 297.5 g/mol
- Monoisotopic mass
- 295.97209
Names & identifiers
- Preferred name
- Magnesium bromide 4-[(oxan-2-yl)sulfanyl]benzen-1-ide (1/1/1)
- IUPAC
- magnesium;2-phenylsulfanyloxane;bromide
Names & synonyms
850311-93-2DTXSID80827131Magnesium bromide 4-[(oxan-2-yl)sulfanyl]benzen-1-ide (1/1/1)
Database identifiers
- CAS
850311-93-2- PubChem CID
- 78066943
- DTXSID
DTXSID80827131
Properties
Computed structural properties
- Topological polar surface area
- 34.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 237
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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