HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 318220Generated: November 3, 2026
Phenyl phenylmethanesulfonate
Phenyl benzenemethanesulfonate · Benzenemethanesulfonicacid, phenyl ester
https://huagongshe.com/en/chemical/318220
Identifiers & Physical Properties
| CAS No. | 10271-81-5 |
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| Molecular formula | C13H12O3S |
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| Average molar mass | 248.3 g/mol |
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| Monoisotopic mass | 248.05071541 g/mol |
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| SMILES | O=S(=O)(Cc1ccccc1)Oc1ccccc1 |
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| InChIKey | DTVYDCGCCHOJMQ-UHFFFAOYSA-N |
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| PubChem CID | 318220 |
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| ChEMBL | CHEMBL472836 |
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| DTXSID | DTXSID60312373 |
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Chemical & Physical Properties
| XLogP | 3 |
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| Topological polar surface area | 51.8 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 3 |
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| Rotatable bonds | 4 |
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| Heavy atoms | 17 |
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| Formal charge | 0 |
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| Complexity | 306 |
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| GHS pictogram | GHS07 |
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| Signal word | Warning |
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| GHS hazard statements | H302-H315-H319-H335 |
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| GHS precautionary statements | P280-P305+P351+P338 |
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Safety & Regulations
| Signal word | Warning |
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| GHS pictogram | GHS07 |
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| GHS hazard statements | H302-H315-H319-H335 |
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| GHS precautionary statements | P280-P305+P351+P338 |
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