5,6,7-Trimethoxycoumarin
5,6,7-trimethoxychromen-2-one
Also Known As: 5,6,7-Trimethoxycoumarin|fraxinol methyl ether|5,6,7-trimethoxychromen-2-one|567-Trimethoxycoumarin|starbld0036076|UMCKALIN METHYL ETHER|6,7,8-Trimethoxycoumarin|5,6,7-trimethoxy-2H-chromen-2-one|UMCKALIN MONOMETHYL ETHER|5,6,7-trimethoxy-2H-1-benzopyran-2-one|2H-1-Benzopyran-2-one, 5,6,7-trimethoxy-|NP1045|TN3080|FS-6879|2H-1-Benzopyran-2-one,5,6,7-trimethoxy-
CAS: 6035-49-0
| Molecular Formula | C12H12O5 |
|---|---|
| Molecular Weight | 236.06847 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.06847 |
| Monoisotopic Mass | 236.06847 |
| Heavy Atoms | 17 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 6035-49-0 |
|---|---|
| SMILES | COC1=C(C(=C2C=CC(=O)OC2=C1)OC)OC |
| InChIKey | FOBNRKTURPWTQX-UHFFFAOYSA-N |
Product Overview
5,6,7-Trimethoxycoumarin (CAS 6035-49-0), with molecular formula C12H12O5 and molecular weight 236.06847 g/mol. IUPAC: 5,6,7-trimethoxychromen-2-one.
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.
View MSDS →
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