| CAS Number | 164397-14-2 |
| Catalog Number | AG019P00 |
| Chemical Name | 4-methyl-2-(pyrrolidin-1-yl)-1,3-thiazole |
| IUPAC Name | 4-methyl-2-pyrrolidin-1-yl-1,3-thiazole |
| InChI | InChI=1S/C8H12N2S/c1-7-6-11-8(9-7)10-4-2-3-5-10/h6H,2-5H2,1H3 |
| InChI Key | XFAABPUSPQCRIY-UHFFFAOYSA-N |
| MDL Number | MFCD06358046 |
| Molecular Formula | C8H12N2S |
| Molecular Weight | 168.2593 |
| SMILES | CC1N=C(N2CCCC2)SC=1 |
| Synonyms | 4-methyl-2-(pyrrolidin-1-yl)-1,3-thiazole,
164397-14-2,
4-methyl-2-pyrrolidin-1-yl-1,3-thiazole,
AC1M8HQ2,
SCHEMBL3511935,
ZINC3394938,
MCULE-1104929850,
CID2513439,
|
| Complexity | 134 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.258g/mol |
| Monoisotopic Mass | 168.072g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 44.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number