| CAS Number | 92671-70-0 |
| Catalog Number | AG00IHAM(AGN-PC-0W0OQ3) |
| Chemical Name | 2-bromopyridin-3-yl acetate |
| IUPAC Name | (2-bromopyridin-3-yl) acetate |
| InChI | InChI=1S/C7H6BrNO2/c1-5(10)11-6-3-2-4-9-7(6)8/h2-4H,1H3 |
| InChI Key | KBAUPWCLRRXCFP-UHFFFAOYSA-N |
| MDL Number | MFCD00085932 |
| Molecular Formula | C7H6BrNO2 |
| Molecular Weight | 216.0320 |
| SMILES | CC(=O)Oc1cccnc1Br |
| Synonyms | 2-Bromopyridin-3-yl acetate,
92671-70-0,
2-Bromo-3-acetoxypyridine,
2-bromo-3-acetoxy-pyridine,
SCHEMBL2659030,
KBAUPWCLRRXCFP-UHFFFAOYSA-N,
ZINC394176,
3-Pyridinol, 2-bromo-, 3-acetate,
SB18587,
Acetic acid 2-bromo-pyridin-3-yl ester,
KS-0000069V,
3-Pyridinol, 2-bromo-, acetate (ester),
AS-54235,
CS-0051984,
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| Complexity | 151 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.958g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.034g/mol |
| Monoisotopic Mass | 214.958g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number