Isopropyl 3,4,5-trihydroxybenzoate
propan-2-yl 3,4,5-trihydroxybenzoate
CAS: 1138-60-9
| Molecular Formula | C10H12O5 |
|---|---|
| Molecular Weight | 212.2 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 87.0 A2 |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 212.06847 |
| Heavy Atoms | 15 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 1138-60-9 |
|---|---|
| SMILES | CC(C)OC(=O)C1=CC(=C(C(=C1)O)O)O |
| InChIKey | TXGSOSAONMOPDL-UHFFFAOYSA-N |
📖 Product Overview
Isopropyl 3,4,5-trihydroxybenzoate (CAS: 1138-60-9) is a chemical compound with molecular formula C10H12O5 and molecular weight 212.2 g/mol. Its IUPAC systematic name is propan-2-yl 3,4,5-trihydroxybenzoate.
TXGSOSAONMOPDL-UHFFFAOYSA-N.
SMILES: CC(C)OC(=O)C1=CC(=C(C(=C1)O)O)O.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Frequently Asked Questions
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What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
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📚 Academic Support
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