Basic information
- CAS
1950-78-3- Standard SMILES
Cc1ccc(S(=O)(=O)I)cc1- InChIKey
YDZYREHHCRHTRZ-UHFFFAOYSA-N- Molecular formula
- C7H7IO2S
- Average molar mass
- 282.1 g/mol
- Monoisotopic mass
- 281.92114846
Names & identifiers
- Preferred name
- p-Toluenesulphonyl iodide
- IUPAC
- 4-methylbenzenesulfonyl iodide
Names & synonyms
1950-78-3p-toluenesulphonyl iodideDTXSID00452287RefChem:1094234DTXCID304031064-methylbenzene-1-sulfonyl iodide4-methylbenzenesulfonyl IodideBenzenesulfonyl iodide, 4-methyl-tosyl iodideiodotosylatetoluene-4-sulfonyl iodide4-Methyl-benzenesulfonyl iodide
Show more names
SCHEMBL3366860YDZYREHHCRHTRZ-UHFFFAOYSA-NEN300-200696
Database identifiers
- CAS
1950-78-3- PubChem CID
- 11022347
- DTXSID
DTXSID00452287- Nikkaji
- J1.810.998K
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 209
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Related reactions
5 records
Compound notes
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