PMF
PHENYLMETHYLSULFONYL FLUORIDE
Created: | 2001-03-29 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 18 |
Chiral Atom Count | 0 |
Bond Count | 18 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | PHENYLMETHYLSULFONYL FLUORIDE |
Synonyms | PMSF |
Systematic Name (OpenEye OEToolkits) | phenylmethanesulfonyl fluoride |
Formula | C7 H7 F O2 S |
Molecular Weight | 174.193 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 2.87 | FS(=O)(=O)Cc1ccccc1 |
SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)CS(=O)(=O)F |
Canonical SMILES | CACTVS | 2.87 | FS(=O)(=O)Cc1ccccc1 |
Canonical SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)CS(=O)(=O)F |
InChI | InChI | 1.03 | InChI=1S/C7H7FO2S/c8-11(9,10)6-7-4-2-1-3-5-7/h1-5H,6H2 |
InChIKey | InChI | 1.03 | YBYRMVIVWMBXKQ-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 4784 |
ChEMBL | CHEMBL190503 |
ChEBI | CHEBI:8102 |
CCDC/CSD | WENZOF |
COD | 2210654 |