| CAS Number | 959986-18-6 |
| Catalog Number | AG019EWO |
| Chemical Name | 5-(3-bromophenyl)-2-chloro-1,3-thiazole |
| IUPAC Name | 5-(3-bromophenyl)-2-chloro-1,3-thiazole |
| InChI | InChI=1S/C9H5BrClNS/c10-7-3-1-2-6(4-7)8-5-12-9(11)13-8/h1-5H |
| InChI Key | WWEMFLPMJMFBLI-UHFFFAOYSA-N |
| MDL Number | MFCD27935033 |
| Molecular Formula | C9H5BrClNS |
| Molecular Weight | 274.5647 |
| SMILES | Clc1ncc(s1)-c1cccc(Br)c1 |
| Synonyms | 5-(3-bromophenyl)-2-chlorothiazole,
959986-18-6,
Thiazole, 5-(3-bromophenyl)-2-chloro-,
SCHEMBL3176189,
WWEMFLPMJMFBLI-UHFFFAOYSA-N,
MFCD27935033,
ZINC150277356,
DA-00176,
5-(3-bromophenyl)-2-chloro-1,3-thiazole,
CS-0062261,
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| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 272.901g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 274.56g/mol |
| Monoisotopic Mass | 272.901g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number