| CAS Number | 379728-05-9 |
| Catalog Number | AG019H4F |
| Chemical Name | N-(4-chlorophenyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine |
| IUPAC Name | N-(4-chlorophenyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine |
| InChI | InChI=1S/C11H13ClN2S/c1-2-9-7-15-11(13-9)14-10-5-3-8(12)4-6-10/h3-6,9H,2,7H2,1H3,(H,13,14) |
| InChI Key | MDPWFUVYQUIMIZ-UHFFFAOYSA-N |
| MDL Number | MFCD03152620 |
| Molecular Formula | C11H13ClN2S |
| Molecular Weight | 240.7523 |
| SMILES | CCC1N=C(NC2=CC=C(Cl)C=C2)SC1 |
| Synonyms | N-(4-chlorophenyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine,
379728-05-9,
(4-Chloro-phenyl)-(4-ethyl-4,5-dihydro-thiazol-2-yl)-amine,
AC1N6LWG,
AC1Q2UDB,
CTK6D2536,
SBB038367,
AKOS000116009,
AKOS016038891,
MCULE-6829686463,
NE41205,
EN300-02504,
(4-chlorophenyl)(4-ethyl(1,3-thiazolin-2-yl))amine,
Z56827498,
ZINC03227157,
CID4236937,
|
| Complexity | 237 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.749g/mol |
| Monoisotopic Mass | 240.049g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 49.7A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number