Vanillylmandelic acid
2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetic acid
CAS: 55-10-7
| Molecular Formula | C9H10O5 |
|---|---|
| Molecular Weight | 198.17 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 87.0 A2 |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.05283 |
| Heavy Atoms | 14 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 55-10-7 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C(C(=O)O)O)O |
| InChIKey | CGQCWMIAEPEHNQ-UHFFFAOYSA-N |
📖 Product Overview
Vanillylmandelic acid (CAS: 55-10-7) is a chemical compound with molecular formula C9H10O5 and molecular weight 198.17 g/mol. Its IUPAC systematic name is 2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetic acid.
CGQCWMIAEPEHNQ-UHFFFAOYSA-N.
SMILES: COC1=C(C=CC(=C1)C(C(=O)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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What documentation do you provide with the product?
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📚 Academic Support
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