| CAS Number | 749920-38-5 |
| Catalog Number | AG019JMY |
| Chemical Name | 2-[2-(furan-2-yl)-2-oxoethylidene]-1,3-thiazolidin-4-one |
| IUPAC Name | 2-[2-(furan-2-yl)-2-oxoethylidene]-1,3-thiazolidin-4-one |
| InChI | InChI=1S/C9H7NO3S/c11-6(7-2-1-3-13-7)4-9-10-8(12)5-14-9/h1-4H,5H2,(H,10,12) |
| InChI Key | XALRCXXRWJXPSZ-UHFFFAOYSA-N |
| MDL Number | MFCD26143599 |
| Molecular Formula | C9H7NO3S |
| Molecular Weight | 209.2218 |
| SMILES | O=C(C1OC=CC=1)C=C1SCC(=O)N1 |
| Synonyms | 2-[2-(furan-2-yl)-2-oxoethylidene]-1,3-thiazolidin-4-one,
749920-38-5,
AC1MX9SC,
CTK7H4526,
MCULE-2250181929,
Z56989599,
ZINC02656407,
CID3762230,
(2E)-2-[2-(2-furyl)-2-oxoethylidene]-1,3-thiazolidin-4-one,
|
| Complexity | 300 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.219g/mol |
| Monoisotopic Mass | 209.015g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 84.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number