| CAS Number | 1250706-48-9 |
| Catalog Number | AG01AIPL |
| Chemical Name | 1-[2-(2-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethan-1-ol |
| IUPAC Name | 1-[2-(2-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethanol |
| InChI | InChI=1S/C12H12FNOS/c1-7-11(8(2)15)16-12(14-7)9-5-3-4-6-10(9)13/h3-6,8,15H,1-2H3 |
| InChI Key | PLZJBIRRCPLZDA-UHFFFAOYSA-N |
| MDL Number | MFCD16112735 |
| Molecular Formula | C12H12FNOS |
| Molecular Weight | 237.2932 |
| SMILES | CC(C1=C(C)N=C(C2=C(F)C=CC=C2)S1)O |
| Synonyms | 1-[2-(2-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethan-1-ol,
1250706-48-9,
AKOS011079456,
MCULE-8201440828,
NE15948,
EN300-78670,
Z1259040935,
|
| Complexity | 241 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.062g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.292g/mol |
| Monoisotopic Mass | 237.062g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 61.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
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Certificate of Analysis
Lot Number