| CAS Number | 41981-63-9 |
| Catalog Number | AG00D730 |
| Chemical Name | 2-Methyl-4-propyl-1,3-thiazole |
| EC Number | 609-976-8 |
| IUPAC Name | 2-methyl-4-propyl-1,3-thiazole |
| InChI | InChI=1S/C7H11NS/c1-3-4-7-5-9-6(2)8-7/h5H,3-4H2,1-2H3 |
| InChI Key | KPTRSWJGYUCLLM-UHFFFAOYSA-N |
| MDL Number | MFCD26797022 |
| Molecular Formula | C7H11NS |
| Molecular Weight | 141.2339 |
| SMILES | CCCC1N=C(C)SC=1 |
| Synonyms | 2-METHYL-4-PROPYLTHIAZOLE,
Thiazole, 2-methyl-4-propyl-,
2-Methyl-4-propyl-1,3-thiazole #,
CID39071,
41981-63-9,
2-Methyl-4-propyl-1,3-thiazole,
SCHEMBL1107413,
CTK8I6891,
DTXSID80194794,
KPTRSWJGYUCLLM-UHFFFAOYSA-N,
AC1L2107,
ZINC2006568,
|
| Complexity | 85 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 141.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 141.232g/mol |
| Monoisotopic Mass | 141.061g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number