1-(4-Toluenesulfonyl)-2-(4-toluenesulfonyloxymethyl)-4-(4-toluenesulfonyloxy)-pyrrolidine

HCID 296100

Basic information

Standard SMILES
Cc1ccc(S(=O)(=O)OCC2CC(OS(=O)(=O)c3ccc(C)cc3)CN2S(=O)(=O)c2ccc(C)cc2)cc1
InChIKey
UJDJLZINFVKBBH-UHFFFAOYSA-N
Molecular formula
C26H29NO8S3
Average molar mass
579.7 g/mol

Names & identifiers

Preferred name
1-(4-Toluenesulfonyl)-2-(4-toluenesulfonyloxymethyl)-4-(4-toluenesulfonyloxy)-pyrrolidine
IUPAC
[1-(4-methylphenyl)sulfonyl-4-(4-methylphenyl)sulfonyloxypyrrolidin-2-yl]methyl 4-methylbenzenesulfonate

Names & synonyms

NSC165892SCHEMBL1569030UJDJLZINFVKBBH-UHFFFAOYSA-NNSC-1658921-(4-TOLUENESULFONYL)-2-(4-TOLUENESULFONYLOXYMETHYL)-4-(4-TOLUENESULFONYLOXY)-PYRROLIDINE

Database identifiers

PubChem CID
296100

Properties

Computed structural properties

XLogP
4.4
Topological polar surface area
149 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
9
Rotatable bonds
9
Heavy atoms
38

Related reactions

6 records

Linked notes

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