| CAS Number | 224622-12-2 |
| Catalog Number | AG019R8T(AGN-PC-0WO8WH) |
| Chemical Name | (1r)-1-(5-Bromothiophen-2-yl)ethan-1-ol |
| IUPAC Name | (1R)-1-(5-bromothiophen-2-yl)ethanol |
| InChI | InChI=1S/C6H7BrOS/c1-4(8)5-2-3-6(7)9-5/h2-4,8H,1H3/t4-/m1/s1 |
| InChI Key | OTGIFRWTOPRWPY-SCSAIBSYSA-N |
| MDL Number | MFCD14705974 |
| Molecular Formula | C6H7BrOS |
| Molecular Weight | 207.0882 |
| SMILES | C[C@H](C1=CC=C(Br)S1)O |
| Synonyms | (1R)-1-(5-bromothiophen-2-yl)ethan-1-ol,
224622-12-2,
AC1Q29BW,
CTK5J1755,
ZINC36158140,
(R)-1-(5-Bromo-2-thienyl)ethanol,
AKOS011389550,
NE31103,
EN300-89284,
(1S)-1-(5-bromothiophen-2-yl)ethan-1-ol,
|
| Complexity | 99.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.94g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.085g/mol |
| Monoisotopic Mass | 205.94g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 48.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number