| CAS Number | 1247198-05-5 |
| Catalog Number | AG01AKGI(AGN-PC-0WO35N) |
| Chemical Name | 1-(2-Ethyl-4-methyl-1,3-thiazol-5-yl)ethan-1-ol |
| IUPAC Name | 1-(2-ethyl-4-methyl-1,3-thiazol-5-yl)ethanol |
| InChI | InChI=1S/C8H13NOS/c1-4-7-9-5(2)8(11-7)6(3)10/h6,10H,4H2,1-3H3 |
| InChI Key | WCQXPDSIATYONZ-UHFFFAOYSA-N |
| MDL Number | MFCD16112723 |
| Molecular Formula | C8H13NOS |
| Molecular Weight | 171.2599 |
| SMILES | CCC1SC(C(O)C)=C(C)N=1 |
| Synonyms | 1-(2-ethyl-4-methyl-1,3-thiazol-5-yl)ethan-1-ol,
1247198-05-5,
AKOS011078672,
MCULE-5515339927,
NE15944,
EN300-84073,
Z1258578217,
|
| Complexity | 131 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 171.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 171.258g/mol |
| Monoisotopic Mass | 171.072g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 61.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number