| CAS Number | 167155-54-6 |
| Catalog Number | AG019SFX(AGN-PC-0WNN98) |
| Chemical Name | 4-(Chloromethyl)-2-(methoxymethyl)-1,3-thiazole |
| IUPAC Name | 4-(chloromethyl)-2-(methoxymethyl)-1,3-thiazole |
| InChI | InChI=1S/C6H8ClNOS/c1-9-3-6-8-5(2-7)4-10-6/h4H,2-3H2,1H3 |
| InChI Key | LVUAQOMXCHGZDW-UHFFFAOYSA-N |
| MDL Number | MFCD11178189 |
| Molecular Formula | C6H8ClNOS |
| Molecular Weight | 177.6518 |
| SMILES | COCC1SC=C(CCl)N=1 |
| Synonyms | 4-(chloromethyl)-2-(methoxymethyl)-1,3-thiazole,
167155-54-6,
Thiazole, 4-(chloromethyl)-2-(methoxymethyl)-,
SCHEMBL8123118,
LVUAQOMXCHGZDW-UHFFFAOYSA-N,
ZINC26511167,
AKOS009303285,
NE58087,
4-Chloromethyl-2-methoxymethyl-1,3-thiazole,
EN300-93492,
|
| Complexity | 104 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.002g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.646g/mol |
| Monoisotopic Mass | 177.002g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 50.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number