| CAS Number | 1049746-46-4 |
| Catalog Number | AG00HAIW(AGN-PC-0WR4KL) |
| Chemical Name | 4-(Chloromethyl)-n-(4-methoxyphenyl)-1,3-thiazol-2-amine, HCl |
| IUPAC Name | 4-(chloromethyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine;hydrochloride |
| InChI | InChI=1S/C11H11ClN2OS.ClH/c1-15-10-4-2-8(3-5-10)13-11-14-9(6-12)7-16-11;/h2-5,7H,6H2,1H3,(H,13,14);1H |
| InChI Key | FGHKOSLPADBEAJ-UHFFFAOYSA-N |
| MDL Number | MFCD07288528 |
| Molecular Formula | C11H12Cl2N2OS |
| Molecular Weight | 291.1968 |
| SMILES | Cl.COC1=CC=C(NC2SC=C(CCl)N=2)C=C1 |
| Synonyms | 4-(chloromethyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine hydrochloride,
1049746-46-4,
AC1Q3C3U,
CTK7A4876,
MFCD07288528,
AKOS008967703,
NE23939,
EN300-10432,
4-(Chloromethyl)-n-(4-methoxyphenyl)-1,3-thiazol-2-amine, HCl,
|
| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 290.005g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 291.19g/mol |
| Monoisotopic Mass | 290.005g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 62.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number