| CAS Number | 933702-08-0 |
| Catalog Number | AG01AF7A(AGN-PC-0WO7P0) |
| Chemical Name | 2-[(Pyrrolidin-3-yloxy)methyl]-1,3-thiazole |
| IUPAC Name | 2-(pyrrolidin-3-yloxymethyl)-1,3-thiazole |
| InChI | InChI=1S/C8H12N2OS/c1-2-9-5-7(1)11-6-8-10-3-4-12-8/h3-4,7,9H,1-2,5-6H2 |
| InChI Key | BNHTVWFUKJBIGY-UHFFFAOYSA-N |
| MDL Number | MFCD23873225 |
| Molecular Formula | C8H12N2OS |
| Molecular Weight | 184.2587 |
| SMILES | C(C1SC=CN=1)OC1CNCC1 |
| Synonyms | 2-[(pyrrolidin-3-yloxy)methyl]-1,3-thiazole,
933702-08-0,
CHEMBL4072787,
AKOS018878178,
NE55945,
F8889-4993,
|
| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.257g/mol |
| Monoisotopic Mass | 184.067g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 62.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
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Certificate of Analysis
Lot Number