| CAS Number | 73919-92-3 |
| Catalog Number | AG019VHA(AGN-PC-00JVLZ) |
| Chemical Name | 2-Bromo-4-(chloromethyl)thiophene |
| IUPAC Name | 2-bromo-4-(chloromethyl)thiophene |
| InChI | InChI=1S/C5H4BrClS/c6-5-1-4(2-7)3-8-5/h1,3H,2H2 |
| InChI Key | CDFSPUOWARZVSY-UHFFFAOYSA-N |
| MDL Number | MFCD12197174 |
| Molecular Formula | C5H4BrClS |
| Molecular Weight | 211.5073 |
| SMILES | ClCC1C=C(Br)SC=1 |
| Synonyms | 2-bromo-4-(chloromethyl)thiophene,
73919-92-3,
AC1Q3U3C,
SCHEMBL8255511,
2-bromo-4-chloromethylthiophene,
CTK6H6750,
CDFSPUOWARZVSY-UHFFFAOYSA-N,
ZINC36379462,
AKOS025147411,
NE21642,
Thiophene, 2-bromo-4-(chloromethyl)-,
EN300-45239,
2-Bromo-4-chloromethyl-thiophene,
|
| Complexity | 78.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.891g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.501g/mol |
| Monoisotopic Mass | 209.891g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 28.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number