6-Isothiocyanato-7-methoxy-4-methylchromen-2-one
6-isothiocyanato-7-methoxy-4-methylchromen-2-one
Also Known As: 6-isothiocyanato-7-methoxy-4-methyl-benzopyran-2-one|6-isothiocyanato-7-methoxy-4-methylchromen-2-one
CAS: 501079-99-8
| Molecular Formula | C12H9NO3S |
|---|---|
| Molecular Weight | 247.03032 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 80.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.03032 |
| Monoisotopic Mass | 247.03032 |
| Heavy Atoms | 17 |
| Complexity | 401.0 |
Chemical Identifiers
| CAS Number | 501079-99-8 |
|---|---|
| SMILES | CC1=CC(=O)OC2=CC(=C(C=C12)N=C=S)OC |
| InChIKey | NKQKJXGYUAAOLS-UHFFFAOYSA-N |
Product Overview
6-Isothiocyanato-7-methoxy-4-methylchromen-2-one (CAS 501079-99-8), with molecular formula C12H9NO3S and molecular weight 247.03032 g/mol. IUPAC: 6-isothiocyanato-7-methoxy-4-methylchromen-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.
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6-Isothiocyanato-7-methoxy-4-methylchromen-2-one is a custom synthesis product. We offer services from milligram to kilogram scale.
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