![Methyl 4-[4-(1,3-dioxoisoindol-2-yl)-3-hydroxyiminobutyl]sulfanylbenzoate structure](/static/products/6742/67425-99-4.webp)
Methyl 4-[4-(1,3-dioxoisoindol-2-yl)-3-hydroxyiminobutyl]sulfanylbenzoate
methyl 4-[4-(1,3-dioxoisoindol-2-yl)-3-hydroxyiminobutyl]sulfanylbenzoate
Also Known As: methyl 4-[(3E)-4-(1,3-dioxoisoindol-2-yl)-3-hydroxyiminobuty|methyl 4-[4-(1,3-dioxoisoindol-2-yl)-3-hydroxyiminobutyl]sulfanylbenzoate
CAS: 67425-99-4
| Molecular Formula | C20H18N2O5S |
|---|---|
| Molecular Weight | 398.09363 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 398.09363 |
| Monoisotopic Mass | 398.09363 |
| Heavy Atoms | 28 |
| Complexity | 606.0 |
Chemical Identifiers
| CAS Number | 67425-99-4 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)SCCC(=NO)CN2C(=O)C3=CC=CC=C3C2=O |
| InChIKey | MRWUVRKFROOQHI-UHFFFAOYSA-N |
Product Overview
Methyl 4-[4-(1,3-dioxoisoindol-2-yl)-3-hydroxyiminobutyl]sulfanylbenzoate (CAS 67425-99-4), with molecular formula C20H18N2O5S and molecular weight 398.09363 g/mol. IUPAC: methyl 4-[4-(1,3-dioxoisoindol-2-yl)-3-hydroxyiminobutyl]sulfanylbenzoate.
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 →
Methyl 4-[4-(1,3-dioxoisoindol-2-yl)-3-hydroxyiminobutyl]sulfanylbenzoate is a custom synthesis product. We offer services from milligram to kilogram scale.
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