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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 86747189Generated: October 23, 2026

(2S, 4S)-2-(N,N-Dimethylcarbamoyl)-4-(4-methoxybenzylthio)-1,1-dimethylpyrrolidinium fluorosulfonate

https://huagongshe.com/en/chemical/86747189

(2S, 4S)-2-(N,N-Dimethylcarbamoyl)-4-(4-methoxybenzylthio)-1,1-dimethylpyrrolidinium fluorosulfonate molecular structure

Identifiers & Physical Properties

Molecular formulaC17H27FN2O5S2
Average molar mass422.5 g/mol
SMILESCOc1ccc(CS[C@H]2C[C@@H](C(=O)N(C)C)[N+](C)(C)C2)cc1.O=S(=O)([O-])F
InChIKeyCKMMALFANMFPQD-MOGJOVFKSA-M
PubChem CID86747189

Chemical & Physical Properties

Topological polar surface area120
Hydrogen bond donors0
Hydrogen bond acceptors7
Rotatable bonds5
Heavy atoms27
Formal charge0
Complexity458