| CAS Number | 1343754-88-0 |
| Catalog Number | AG01DVVM |
| Chemical Name | ethyl 2-[(6-bromopyridin-2-yl)sulfanyl]acetate |
| IUPAC Name | ethyl 2-(6-bromopyridin-2-yl)sulfanylacetate |
| InChI | InChI=1S/C9H10BrNO2S/c1-2-13-9(12)6-14-8-5-3-4-7(10)11-8/h3-5H,2,6H2,1H3 |
| InChI Key | ULONITWHOGVJAD-UHFFFAOYSA-N |
| MDL Number | MFCD19620408 |
| Molecular Formula | C9H10BrNO2S |
| Molecular Weight | 276.1502 |
| SMILES | CCOC(CSC1=NC(Br)=CC=C1)=O |
| Synonyms | ethyl 2-[(6-bromopyridin-2-yl)sulfanyl]acetate,
1343754-88-0,
AKOS013277692,
|
| Complexity | 192 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 274.962g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 276.148g/mol |
| Monoisotopic Mass | 274.962g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 64.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
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Certificate of Analysis
Lot Number