| CAS Number | 128146-85-0 |
| Catalog Number | AG00IM75(AGN-PC-0NIJX4) |
| Chemical Name | 5-Methylisothiazol-3-amine |
| IUPAC Name | 5-methyl-1,2-thiazol-3-amine |
| InChI | InChI=1S/C4H6N2S/c1-3-2-4(5)6-7-3/h2H,1H3,(H2,5,6) |
| InChI Key | BEIBQYMQSIDAIS-UHFFFAOYSA-N |
| MDL Number | MFCD19203320 |
| Molecular Formula | C4H6N2S |
| Molecular Weight | 114.1688 |
| SMILES | CC1SN=C(N)C=1 |
| Synonyms | 5-Methylisothiazol-3-amine,
128146-85-0,
5-methyl-isothiazol-3-ylamine,
5-methyl-1,2-thiazol-3-amine,
5-Methylisothiazole-3-amine,
3-Isothiazolamine, 5-methyl-,
SCHEMBL2629394,
ZINC2548177,
AKOS006339523,
CS-15507,
CS-0040519,
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| Complexity | 66.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 114.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 114.166g/mol |
| Monoisotopic Mass | 114.025g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 67.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number