| CAS Number | 160096-74-2 |
| Catalog Number | AG00IMGL(AGN-PC-0WQUME) |
| Chemical Name | 2,5-Dibromo-3-tetradecylthiophene |
| IUPAC Name | 2,5-dibromo-3-tetradecylthiophene |
| InChI | InChI=1S/C18H30Br2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-15-17(19)21-18(16)20/h15H,2-14H2,1H3 |
| InChI Key | IYQPIBPAABQINF-UHFFFAOYSA-N |
| MDL Number | MFCD30742898 |
| Molecular Formula | C18H30Br2S |
| Molecular Weight | 438.3038 |
| SMILES | CCCCCCCCCCCCCCC1=C(SC(=C1)Br)Br |
| Synonyms | 2,5-Dibromo-3-tetradecylthiophene,
160096-74-2,
D5241,
Thiophene, 2,5-dibromo-3-tetradecyl-,
|
| Complexity | 235 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 438.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 438.306g/mol |
| Monoisotopic Mass | 436.043g/mol |
| Rotatable Bond Count | 13 |
| Topological Polar Surface Area | 28.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 10.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number