HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 786Generated: October 27, 2026
P-(4-Hydroxy-3-methyl-2-buten-1-yl) trihydrogen (diphosphate)
https://huagongshe.com/en/chemical/786
Identifiers & Physical Properties
| CAS No. | 773050-78-5 |
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| Molecular formula | C5H12O8P2 |
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| Average molar mass | 262.09 g/mol |
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| Monoisotopic mass | 262.00074133 g/mol |
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| SMILES | CC(=CCOP(=O)(O)OP(=O)(O)O)CO |
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| InChIKey | MDSIZRKJVDMQOQ-UHFFFAOYSA-N |
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| PubChem CID | 786 |
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| DTXSID | DTXSID101182096 |
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Chemical & Physical Properties
| XLogP | -2.4 |
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| Topological polar surface area | 134 |
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| Hydrogen bond donors | 4 |
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| Hydrogen bond acceptors | 8 |
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| Rotatable bonds | 6 |
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| Heavy atoms | 15 |
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| Formal charge | 0 |
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| Complexity | 317 |
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