| CAS Number | 17265-61-1 |
| Catalog Number | AG01DYUZ(AGN-PC-02VC69) |
| Chemical Name | (3-Methyl-1,2-thiazol-4-YL)methanol |
| IUPAC Name | (3-methyl-1,2-thiazol-4-yl)methanol |
| InChI | InChI=1S/C5H7NOS/c1-4-5(2-7)3-8-6-4/h3,7H,2H2,1H3 |
| InChI Key | ZGCUXZXLJMYGRK-UHFFFAOYSA-N |
| MDL Number | MFCD18089002 |
| Molecular Formula | C5H7NOS |
| Molecular Weight | 129.1802 |
| SMILES | CC1C(CO)=CSN=1 |
| Synonyms | 17265-61-1,
4-Isothiazolemethanol, 3-methyl-,
SCHEMBL11239867,
ZGCUXZXLJMYGRK-UHFFFAOYSA-N,
4-hydroxymethyl-3-methylisothiazole,
ZINC57354327,
(3-METHYL-1,2-THIAZOL-4-YL)METHANOL,
(3-methylisothiazol-4-yl)methanol,
|
| Complexity | 78.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 129.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 129.177g/mol |
| Monoisotopic Mass | 129.025g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 61.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number