PMF

PHENYLMETHYLSULFONYL FLUORIDE

Created: 2001-03-29
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count18
Chiral Atom Count0
Bond Count18
Aromatic Bond Count6
2D diagram of PMF

Chemical Component Summary

NamePHENYLMETHYLSULFONYL FLUORIDE
SynonymsPMSF
Systematic Name (OpenEye OEToolkits)phenylmethanesulfonyl fluoride
FormulaC7 H7 F O2 S
Molecular Weight174.193
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS2.87FS(=O)(=O)Cc1ccccc1
SMILESOpenEye OEToolkits1.5.0c1ccc(cc1)CS(=O)(=O)F
Canonical SMILESCACTVS2.87 FS(=O)(=O)Cc1ccccc1
Canonical SMILESOpenEye OEToolkits1.5.0 c1ccc(cc1)CS(=O)(=O)F
InChIInChI1.03 InChI=1S/C7H7FO2S/c8-11(9,10)6-7-4-2-1-3-5-7/h1-5H,6H2
InChIKeyInChI1.03 YBYRMVIVWMBXKQ-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 4784
ChEMBL CHEMBL190503
ChEBI CHEBI:8102
CCDC/CSD WENZOF
COD 2210654