| CAS Number | 16312-19-9 |
| Catalog Number | AG001TSB(AGN-PC-0NJYTM) |
| Chemical Name | 2-(Methylamino)thiazol-4(5H)-one |
| IUPAC Name | 2-methylimino-1,3-thiazolidin-4-one |
| InChI | InChI=1S/C4H6N2OS/c1-5-4-6-3(7)2-8-4/h2H2,1H3,(H,5,6,7) |
| InChI Key | DDHGVUYPMIUDTI-UHFFFAOYSA-N |
| MDL Number | MFCD13184172 |
| Molecular Formula | C4H6N2OS |
| Molecular Weight | 130.1682 |
| SMILES | CNC1SCC(=O)N=1 |
| Synonyms | 16312-19-9,
4(5H)-Thiazolone, 2-(methylamino)-,
SCHEMBL84732,
2-methylamino-4-thiazolinone,
SCHEMBL13921709,
CTK0A9383,
DTXSID20507460,
2-(Methylamino)thiazol-4(5H)-one,
ZINC39134646,
AKOS006351297,
2-(Methylamino)-1,3-thiazol-4(5H)-one,
2-(methylamino)-4,5-dihydro-1,3-thiazol-4-one,
Z2513334563,
2-(methylamino)-1,3-thiazol-4-one,
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| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 130.02g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 130.165g/mol |
| Monoisotopic Mass | 130.02g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 66.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number