| CAS Number | 30216-49-0 |
| Catalog Number | AG01AIX2(AGN-PC-0WO2CX) |
| Chemical Name | 4-(2-Bromophenyl)-1,3-thiazole |
| IUPAC Name | 4-(2-bromophenyl)-1,3-thiazole |
| InChI | InChI=1S/C9H6BrNS/c10-8-4-2-1-3-7(8)9-5-12-6-11-9/h1-6H |
| InChI Key | ZFMNKQKZWGAYGX-UHFFFAOYSA-N |
| MDL Number | MFCD02665936 |
| Molecular Formula | C9H6BrNS |
| Molecular Weight | 240.1196 |
| SMILES | BrC1=C(C2N=CSC=2)C=CC=C1 |
| Synonyms | 4-(2-bromophenyl)-1,3-thiazole,
30216-49-0,
AC1NFKWM,
SCHEMBL4518539,
ZINC1520195,
STL453429,
AKOS017411946,
MCULE-7118649948,
NE12119,
EN300-79248,
CID4685184,
|
| Complexity | 154 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 238.94g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.118g/mol |
| Monoisotopic Mass | 238.94g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number