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SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Canonical Smiles | C1=CC(=CC=C1C2=NC(=CC(=O)S2)O)Cl |
|---|---|
| IUPAC Name | 2-(4-chlorophenyl)-4-hydroxy-1,3-thiazin-6-one |
| InChIKey | XVGBBRBZACTKJH-UHFFFAOYSA-N |
| INCHI | 1S/C10H6ClNO2S/c11-7-3-1-6(2-4-7)10-12-8(13)5-9(14)15-10/h1-5,13H |
| Isomeric SMILES | C1=CC(=CC=C1C2=NC(=CC(=O)S2)O)Cl |
| PubChem CID | 135418574 |
| Molecular Weight | 239.68 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →| Molecular Weight | 239.680 g/mol |
|---|---|
| XLogP3 | 2.500 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 238.981 Da |
| Monoisotopic Mass | 238.981 Da |
| Topological Polar Surface Area | 75.000 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 332.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |