| CAS Number | 1247721-83-0 |
| Catalog Number | AG01AJY3 |
| Chemical Name | 1-[4-methyl-2-(4-methylphenyl)-1,3-thiazol-5-yl]ethan-1-ol |
| IUPAC Name | 1-[4-methyl-2-(4-methylphenyl)-1,3-thiazol-5-yl]ethanol |
| InChI | InChI=1S/C13H15NOS/c1-8-4-6-11(7-5-8)13-14-9(2)12(16-13)10(3)15/h4-7,10,15H,1-3H3 |
| InChI Key | DOIZVBVOICRWBQ-UHFFFAOYSA-N |
| MDL Number | MFCD16112726 |
| Molecular Formula | C13H15NOS |
| Molecular Weight | 233.3293 |
| SMILES | CC(C1=C(C)N=C(C2=CC=C(C)C=C2)S1)O |
| Synonyms | 1-[4-methyl-2-(4-methylphenyl)-1,3-thiazol-5-yl]ethan-1-ol,
1247721-83-0,
AKOS011079064,
MCULE-9914745740,
NE15946,
EN300-82221,
Z1250089984,
|
| Complexity | 228 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 233.087g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 233.329g/mol |
| Monoisotopic Mass | 233.087g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 61.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
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Certificate of Analysis
Lot Number