| CAS Number | 1344367-35-6 |
| Catalog Number | AG01DVVY |
| Chemical Name | 1-{4H,6H,7H-pyrano[4,3-d][1,3]thiazol-2-yl}ethan-1-ol |
| IUPAC Name | 1-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)ethanol |
| InChI | InChI=1S/C8H11NO2S/c1-5(10)8-9-6-2-3-11-4-7(6)12-8/h5,10H,2-4H2,1H3 |
| InChI Key | KRISORPCWOQZAV-UHFFFAOYSA-N |
| MDL Number | MFCD18343940 |
| Molecular Formula | C8H11NO2S |
| Molecular Weight | 185.2434 |
| SMILES | CC(C1SC2=C(CCOC2)N=1)O |
| Synonyms | 1-(4H,6H,7H-PYRANO[4,3-D][1,3]THIAZOL-2-YL)ETHAN-1-OL,
1344367-35-6,
1-{4H,6H,7H-pyrano[4,3-d][1,3]thiazol-2-yl}ethan-1-ol,
AKOS012685819,
|
| Complexity | 167 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 185.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 185.241g/mol |
| Monoisotopic Mass | 185.051g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 70.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
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Certificate of Analysis
Lot Number