| CAS Number | 1248439-09-9 |
| Catalog Number | AG01AJAB(AGN-PC-0WO1E2) |
| Chemical Name | 3-bromo-2-(2-ethoxyethoxy)pyridine |
| IUPAC Name | 3-bromo-2-(2-ethoxyethoxy)pyridine |
| InChI | InChI=1S/C9H12BrNO2/c1-2-12-6-7-13-9-8(10)4-3-5-11-9/h3-5H,2,6-7H2,1H3 |
| InChI Key | MTZOXIXMUOMIHK-UHFFFAOYSA-N |
| MDL Number | MFCD14651764 |
| Molecular Formula | C9H12BrNO2 |
| Molecular Weight | 246.1011 |
| SMILES | CCOCCOC1=C(Br)C=CC=N1 |
| Synonyms | 3-bromo-2-(2-ethoxyethoxy)pyridine,
1248439-09-9,
ZINC42376403,
AKOS008146354,
MCULE-9210896105,
NE15815,
EN300-80190,
Z1251171222,
|
| Complexity | 135 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 245.005g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 246.104g/mol |
| Monoisotopic Mass | 245.005g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 31.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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Certificate of Analysis
Lot Number