| CAS Number | 184840-72-0 |
| Catalog Number | AG00ABA7(AGN-PC-0K1ZYI) |
| Chemical Name | (E)-5-(3-Hydroxybenzylidene)thiazolidine-2,4-dione |
| IUPAC Name | 5-[(3-hydroxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione |
| InChI | InChI=1S/C10H7NO3S/c12-7-3-1-2-6(4-7)5-8-9(13)11-10(14)15-8/h1-5,12H,(H,11,13,14) |
| InChI Key | IKLKVFXCODJJRX-UHFFFAOYSA-N |
| MDL Number | MFCD00640643 |
| Molecular Formula | C10H7NO3S |
| Molecular Weight | 221.2325 |
| SMILES | N1C(=O)/C(/SC1=O)=CC1C=CC=C(O)C=1 |
| Synonyms | 184840-72-0,
(5E)-5-(3-hydroxybenzylidene)-1,3-thiazolidine-2,4-dione,
CHEMBRDG-BB 5378417,
AC1MDX37,
CTK4D8833,
DTXSID80385807,
5-[(3-hydroxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione,
AKOS030240312,
MCULE-3497338022,
5-(3-hydroxybenzylidene)thiazolidine-2,4-dione,
(E)-5-(3-Hydroxybenzylidene)thiazolidine-2,4-dione,
ZINC00975805,
CID2844338,
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| Complexity | 327 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 221.23g/mol |
| Monoisotopic Mass | 221.015g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 91.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number